Clitoriacetal (CHEBI:196369)

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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	Clitoriacetal

ChEBI ID	CHEBI:196369

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C19H18O9

Net Charge

Average Mass

390.344

Monoisotopic Mass

390.09508

InChI

InChI=1S/C19H18O9/c1-24-8-4-10(20)15-14(5-8)27-17-18(22)28-11-7-13(26-3)12(25-2)6-9(11)19(17,23)16(15)21/h4-7,17-18,20,22-23H,1-3H3

InChIKey

CJIMGNHPOXRALG-UHFFFAOYSA-N

SMILES

O1C2C(O)(C=3C(OC2O)=CC(OC)=C(OC)C3)C(=O)C=4C1=CC(OC)=CC4O

ChEBI Ontology
Outgoing	Clitoriacetal (CHEBI:196369) is a rotenones (CHEBI:72581)

IUPAC Name

6,11,12a-trihydroxy-2,3,9-trimethoxy-6,6a-dihydrochromeno[3,4-b]chromen-12-one