Anhydrocinnzeylanol (CHEBI:175709)

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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	Anhydrocinnzeylanol

ChEBI ID	CHEBI:175709

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H30O6

Net Charge

Average Mass

366.454

Monoisotopic Mass

366.20424

InChI

InChI=1S/C20H30O6/c1-10(2)13-8-18(24)16(5)9-14(21)26-20(19(18,25)12(13)4)15(22)11(3)6-7-17(16,20)23/h10-11,15,22-25H,6-9H2,1-5H3

InChIKey

JFDHTDLZWVKRQT-UHFFFAOYSA-N

SMILES

O1C23C(O)(C(C4(O)C2(O)C(=C(C4)C(C)C)C)(CC1=O)C)CCC(C3O)C

ChEBI Ontology
Outgoing	Anhydrocinnzeylanol (CHEBI:175709) is a terpene lactone (CHEBI:37668)

IUPAC Name

2,6,8,12-tetrahydroxy-3,7,11-trimethyl-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-14-one