MiMeDB: Showing metabocard for Luteoforol (MMDBc0053428)

Record Information

Version

2.0

Status

Detected and Quantified

Creation Date

2022-05-16 21:24:20 UTC

Update Date

2025-01-16 08:03:33 UTC

Metabolite ID

MMDBc0053428

Metabolite Identification

Common Name

Luteoforol

Description

Luteoforol is found in cereals and cereal products. Luteoforol is a constituent of Zea mays (sweet corn) and Sorghum vulgare (sorghum).

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₁₅H₁₄O₆

Average Mass

290.2681

Monoisotopic Mass

290.07903818

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C15H14O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,12-13,16-20H,6H2

InChI Key

FSYDWKPCKNCRDI-UHFFFAOYSA-N

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

Not Available

Predicted Properties

Not Available

Spectra

Not Available

Chromatographic Retention Times and Retention Indices

Retention Times

Chromatography Type	Technique	Column	Deposition Date	Retention Time (s)
Liquid Chromatography	HILIC	Waters Acquity UPLC-BEH Amide column (eluted)	2025-10-24	132.3
Liquid Chromatography	HILIC	Accucore 150 Amide HILIC (eluted)	2025-10-24	47.0
Liquid Chromatography	Reversed-phase	Hypersil Gold 1.9 µm C18 (eluted)	2025-10-24	289.6
Liquid Chromatography	Reversed-phase	Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) (eluted)	2025-10-24	364.1
Liquid Chromatography	Reversed-phase	XBridge C18 3.5u 2.1x50 mm (eluted)	2025-10-24	441.5
Liquid Chromatography	Reversed-phase	Ascentis Express C18 (eluted)	2025-10-24	211.1
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	1259.1
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	349.6
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC (eluted)	2025-10-24	263.7
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	164.2
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	360.4
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	139.3
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	104.8
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	234.7
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	518.0
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	86.0
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	236.2
Liquid Chromatography	Reversed-phase	Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex (eluted)	2025-10-24	1090.1
Liquid Chromatography	Reversed-phase	Waters Atlantis T3 (2.1 x 150 mm, 5 um) (eluted)	2025-10-24	666.4

Retention Indices

Chromatography Type	Peak Label	SMILES	Stationary Phase	Deposition Date	Retention Index
Gas Chromatography	Luteoforol_TMS_1	C[Si](C)(C)OC1CC(C2=CC=C(O)C(O)=C2)OC2=CC(O)=CC(O)=C21	standard non polar	2025-10-24	1666.51
Gas Chromatography	Luteoforol_TMS_2	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O)=C1)CC2O	standard non polar	2025-10-24	1778.24
Gas Chromatography	Luteoforol_TMS_3	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)CC(C1=CC=C(O)C(O)=C1)O2	standard non polar	2025-10-24	2081.09
Gas Chromatography	Luteoforol_TMS_4	C[Si](C)(C)OC1=CC(C2CC(O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	standard non polar	2025-10-24	2349.9
Gas Chromatography	Luteoforol_TMS_5	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(O)C=C(O)C=C3O2)C=C1O	standard non polar	2025-10-24	1766.99
Gas Chromatography	Luteoforol_TMS_6	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(O)C=C(O)C=C3O2)C=C1O	standard non polar	2025-10-24	2813.24
Gas Chromatography	Luteoforol_TMS_7	C[Si](C)(C)OC1=CC(C2CC(O[Si](C)(C)C)C3=C(O)C=C(O)C=C3O2)=CC=C1O	standard non polar	2025-10-24	2235.12
Gas Chromatography	Luteoforol_TMS_8	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O)=C1)CC2O[Si](C)(C)C	standard non polar	2025-10-24	1625.48
Gas Chromatography	Luteoforol_TMS_9	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)CC(C1=CC=C(O)C(O)=C1)O2	standard non polar	2025-10-24	2560.76
Gas Chromatography	Luteoforol_TMS_10	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O)C(O)=C1)O2	standard non polar	2025-10-24	2329.99
Gas Chromatography	Luteoforol_TMS_11	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)CC2O	standard non polar	2025-10-24	1999.85
Gas Chromatography	Luteoforol_TMS_12	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)CC2O	standard non polar	2025-10-24	2144.51
Gas Chromatography	Luteoforol_TMS_13	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O	standard non polar	2025-10-24	1113.84
Gas Chromatography	Luteoforol_TMS_14	C[Si](C)(C)OC1=CC(C2CC(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)=CC=C1O	standard non polar	2025-10-24	1779.75
Gas Chromatography	Luteoforol_TMS_15	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	standard non polar	2025-10-24	2693.57
Gas Chromatography	Luteoforol_TMS_16	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O	standard non polar	2025-10-24	1440.01
Gas Chromatography	Luteoforol_TMS_17	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)CC2O[Si](C)(C)C	standard non polar	2025-10-24	1919.04
Gas Chromatography	Luteoforol_TMS_18	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	standard non polar	2025-10-24	2016.78
Gas Chromatography	Luteoforol_TMS_19	C[Si](C)(C)OC1=CC(C2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)=CC=C1O	standard non polar	2025-10-24	2131.0
Gas Chromatography	Luteoforol_TMS_20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)CC2O[Si](C)(C)C	standard non polar	2025-10-24	1706.02
Gas Chromatography	Luteoforol_TMS_21	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O)C(O)=C1)O2	standard non polar	2025-10-24	1981.77
Gas Chromatography	Luteoforol_TMS_22	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)O2	standard non polar	2025-10-24	1875.11
Gas Chromatography	Luteoforol_TMS_23	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)O2	standard non polar	2025-10-24	1804.75
Gas Chromatography	Luteoforol_TMS_24	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)CC2O	standard non polar	2025-10-24	2690.64
Gas Chromatography	Luteoforol_TMS_25	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C	standard non polar	2025-10-24	2205.44
Gas Chromatography	Luteoforol_TMS_26	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)O2	standard non polar	2025-10-24	2044.84
Gas Chromatography	Luteoforol_TMS_27	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C	standard non polar	2025-10-24	814.804
Gas Chromatography	Luteoforol_TMS_28	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)CC2O[Si](C)(C)C	standard non polar	2025-10-24	1807.34
Gas Chromatography	Luteoforol_TMS_29	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)O2	standard non polar	2025-10-24	1542.24
Gas Chromatography	Luteoforol_TMS_30	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	standard non polar	2025-10-24	2214.22
Gas Chromatography	Luteoforol_TMS_31	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	standard non polar	2025-10-24	1389.23
Gas Chromatography	Luteoforol_TMS_1	C[Si](C)(C)OC1CC(C2=CC=C(O)C(O)=C2)OC2=CC(O)=CC(O)=C21	standard polar	2025-10-24	2211.87
Gas Chromatography	Luteoforol_TMS_2	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O)=C1)CC2O	standard polar	2025-10-24	2236.23
Gas Chromatography	Luteoforol_TMS_3	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O)CC(C1=CC=C(O)C(O)=C1)O2	standard polar	2025-10-24	1935.78
Gas Chromatography	Luteoforol_TMS_4	C[Si](C)(C)OC1=CC(C2CC(O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	standard polar	2025-10-24	2070.81
Gas Chromatography	Luteoforol_TMS_5	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(O)C=C(O)C=C3O2)C=C1O	standard polar	2025-10-24	1701.1
Gas Chromatography	Luteoforol_TMS_6	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(O)C=C(O)C=C3O2)C=C1O	standard polar	2025-10-24	3056.68
Gas Chromatography	Luteoforol_TMS_7	C[Si](C)(C)OC1=CC(C2CC(O[Si](C)(C)C)C3=C(O)C=C(O)C=C3O2)=CC=C1O	standard polar	2025-10-24	1986.53
Gas Chromatography	Luteoforol_TMS_8	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O)=C1)CC2O[Si](C)(C)C	standard polar	2025-10-24	2836.03
Gas Chromatography	Luteoforol_TMS_9	C[Si](C)(C)OC1=CC(O)=CC2=C1C(O[Si](C)(C)C)CC(C1=CC=C(O)C(O)=C1)O2	standard polar	2025-10-24	1614.79
Gas Chromatography	Luteoforol_TMS_10	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O)C(O)=C1)O2	standard polar	2025-10-24	3052.29
Gas Chromatography	Luteoforol_TMS_11	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)CC2O	standard polar	2025-10-24	2526.24
Gas Chromatography	Luteoforol_TMS_12	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)CC2O	standard polar	2025-10-24	1722.3
Gas Chromatography	Luteoforol_TMS_13	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O	standard polar	2025-10-24	1277.58
Gas Chromatography	Luteoforol_TMS_14	C[Si](C)(C)OC1=CC(C2CC(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)=CC=C1O	standard polar	2025-10-24	2001.0
Gas Chromatography	Luteoforol_TMS_15	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	standard polar	2025-10-24	2035.48
Gas Chromatography	Luteoforol_TMS_16	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O	standard polar	2025-10-24	2129.78
Gas Chromatography	Luteoforol_TMS_17	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)CC2O[Si](C)(C)C	standard polar	2025-10-24	2235.05
Gas Chromatography	Luteoforol_TMS_18	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	standard polar	2025-10-24	2347.46
Gas Chromatography	Luteoforol_TMS_19	C[Si](C)(C)OC1=CC(C2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)=CC=C1O	standard polar	2025-10-24	1339.4
Gas Chromatography	Luteoforol_TMS_20	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)CC2O[Si](C)(C)C	standard polar	2025-10-24	3590.36
Gas Chromatography	Luteoforol_TMS_21	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O)C(O)=C1)O2	standard polar	2025-10-24	2211.13
Gas Chromatography	Luteoforol_TMS_22	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)O2	standard polar	2025-10-24	1775.13
Gas Chromatography	Luteoforol_TMS_23	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)O2	standard polar	2025-10-24	1704.27
Gas Chromatography	Luteoforol_TMS_24	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)CC2O	standard polar	2025-10-24	1914.17
Gas Chromatography	Luteoforol_TMS_25	C[Si](C)(C)OC1=CC=C(C2CC(O)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C	standard polar	2025-10-24	1531.82
Gas Chromatography	Luteoforol_TMS_26	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O[Si](C)(C)C)C(O)=C1)O2	standard polar	2025-10-24	2293.08
Gas Chromatography	Luteoforol_TMS_27	C[Si](C)(C)OC1=CC=C(C2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C	standard polar	2025-10-24	2309.5
Gas Chromatography	Luteoforol_TMS_28	C[Si](C)(C)OC1=CC(O)=C2C(=C1)OC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)CC2O[Si](C)(C)C	standard polar	2025-10-24	2253.92
Gas Chromatography	Luteoforol_TMS_29	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O)C(O[Si](C)(C)C)=C1)O2	standard polar	2025-10-24	2871.73
Gas Chromatography	Luteoforol_TMS_30	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O)CC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	standard polar	2025-10-24	2041.59
Gas Chromatography	Luteoforol_TMS_31	C[Si](C)(C)OC1=CC2=C(C(O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)CC(C1=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1)O2	standard polar	2025-10-24	1582.01

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

Not Available

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Eukaryota/Fungi	Basidiomycota	8	Human feces
Eukaryota/Fungi	Ascomycota	2

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference

External Links

Not Available

General References

Wishart DS, Li C, Marcu A, Badran H, Pon A, Budinski Z, Patron J, Lipton D, Cao X, Oler E, Li K, Paccoud M, Hong C, Guo AC, Chan C, Wei W, Ramirez-Gaona M: PathBank: a comprehensive pathway database for model organisms. Nucleic Acids Res. 2020 Jan 8;48(D1):D470-D478. doi: 10.1093/nar/gkz861. [PubMed:31602464 ]
Yannai, Shmuel (2004). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. Boca Raton: Chapman & Hall/CRC..

Showing metabocard for Luteoforol (MMDBc0053428)

MOL for #<Metabolite:0x00007f9aa7c4d8c8>

3D MOL for #<Metabolite:0x00007f9aa7c4d8c8>

3D SDF for #<Metabolite:0x00007f9aa7c4d8c8>

3D-SDF for #<Metabolite:0x00007f9aa7c4d8c8>

PDB for #<Metabolite:0x00007f9aa7c4d8c8>

3D PDB for #<Metabolite:0x00007f9aa7c4d8c8>

SMILES for #<Metabolite:0x00007f9aa7c4d8c8>

INCHI for #<Metabolite:0x00007f9aa7c4d8c8>

Structure for #<Metabolite:0x00007f9aa7c4d8c8>

3D Structure for #<Metabolite:0x00007f9aa7c4d8c8>