(-)-8'-epi-aristoligone (CHEBI:70591)

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ChEBI Name	(-)-8'-epi-aristoligone

ChEBI ID	CHEBI:70591

Definition	A natural product found in Holostylis reniformis.

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

Supplier Information

Download	Molfile XML SDF

Formula

C22H26O5

Net Charge

Average Mass

370.43880

Monoisotopic Mass

370.17802

InChI

InChI=1S/C22H26O5/c1-12-13(2)22(23)16-11-20(27-6)19(26-5)10-15(16)21(12)14-7-8-17(24-3)18(9-14)25-4/h7-13,21H,1-6H3/t12-,13+,21-/m1/s1

InChIKey

UCHGPGXURWMCBZ-RRMDADRESA-N

SMILES

COc1ccc(cc1OC)[C@H]1[C@H](C)[C@H](C)C(=O)c2cc(OC)c(OC)cc12

Metabolite of Species	Details
Holostylis reniformis (NCBI:txid304172)	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	(-)-8'-epi-aristoligone (CHEBI:70591) has role metabolite (CHEBI:25212) (-)-8'-epi-aristoligone (CHEBI:70591) is a lignan (CHEBI:25036)

Synonym	Source
(2S,3S,4R)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-3,4-dihydro-2H-naphthalen-1-one	ChEBI

Citation	Type	Source
20961092	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:tetralins(CHEBI:36786); ISA:aromatic ketone(CHEBI:76224); ISA:methoxybenzene(CHEBI:51683); ISA:aromatic ether(CHEBI:35618); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:organic heterocyclic compound(CHEBI:24532);