anadensin (CHEBI:67830)

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ChEBI Name	anadensin

ChEBI ID	CHEBI:67830

Definition	A natural product found in Porella chilensis and Anastrepta orcadensis.

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

Supplier Information

Download	Molfile XML SDF

Formula

C20H32O2

Net Charge

Average Mass

304.46690

Monoisotopic Mass

304.24023

InChI

InChI=1S/C20H32O2/c1-12(2)15-8-9-19(5)11-20(22)14(4)18(21)10-17(20)13(3)6-7-16(15)19/h10,12-16,22H,6-9,11H2,1-5H3/t13-,14+,15+,16-,19+,20+/m0/s1

InChIKey

JJHOOGDZTIBHQQ-CCOVMOLUSA-N

SMILES

[H][C@@]12CC[C@H](C)C3=CC(=O)[C@@H](C)[C@]3(O)C[C@@]1(C)CC[C@@H]2C(C)C

Metabolite of Species	Details
Anastrepta orcadensis (NCBI:txid264780)	See: PubMed
Porella chilensis (NCBI:txid462342)	The air-dried plant material was extracted with diethyl ether and then with methanol See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	anadensin (CHEBI:67830) has role metabolite (CHEBI:25212) anadensin (CHEBI:67830) is a sesquiterpenoid (CHEBI:26658)

Synonym	Source
(1S,4S,6aS,7R,9aR,10aR)-10a-Hydroxy-7-isopropyl-1,4,9a-trimethyl-4,5,6,6a,7,8,9,9a,10,10a-decahydrodicyclopenta[a,d][8]annulen-2(1H)-one	ChEBI

Citation	Type	Source
21384863	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:tertiary alcohol(CHEBI:26878); ISA:cyclic ketone(CHEBI:3992); ISA:organic hydroxy compound(CHEBI:33822);