Carinol (CHEBI:172610)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Carinol

ChEBI ID	CHEBI:172610

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H26O7

Net Charge

Average Mass

378.421

Monoisotopic Mass

378.16785

InChI

InChI=1S/C20H26O7/c1-26-18-8-13(3-5-16(18)23)7-15(11-21)20(25,12-22)10-14-4-6-17(24)19(9-14)27-2/h3-6,8-9,15,21-25H,7,10-12H2,1-2H3

InChIKey

INPPVVSEQRZCLJ-UHFFFAOYSA-N

SMILES

OC(C(CC1=CC(OC)=C(O)C=C1)CO)(CC2=CC(OC)=C(O)C=C2)CO

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). See: MetaboLights Study

ChEBI Ontology
Outgoing	Carinol (CHEBI:172610) is a lignan (CHEBI:25036)

IUPAC Name

2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butane-1,2,4-triol