CHEBI:70672 - Boehmenan

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ChEBI Name Boehmenan
ChEBI ID CHEBI:70672
Definition A natural product found particularly in Durio oxleyanus and Helicteres hirsuta.
Stars This entity has been manually annotated by a third party.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C40H40O12
Net Charge 0
Average Mass 712.73840
Monoisotopic Mass 712.25198
InChI InChI=1S/C40H40O12/c1-46-33-19-24(7-12-30(33)41)9-15-37(44)50-17-5-6-26-18-28-29(23-51-38(45)16-10-25-8-13-31(42)34(20-25)47-2)39(52-40(28)36(21-26)49-4)27-11-14-32(43)35(22-27)48-3/h7-16,18-22,29,39,41-43H,5-6,17,23H2,1-4H3/b15-9+,16-10+
InChIKey OVFZHMPISOASDF-KAVGSWPWSA-N
SMILES COc1cc(\C=C\C(=O)OCCCc2cc(OC)c3OC(C(COC(=O)\C=C\c4ccc(O)c(OC)c4)c3c2)c2ccc(O)c(OC)c2)ccc1O
Metabolite of Species Details
Helicteres hirsuta (IPNI:51446-3) See: DOI
Durio oxleyanus (NCBI:txid117662) Found in bark (BTO:0001301). Chloroform soluble components of methanolic extract of bark See: DOI
Durio carinatus (NCBI:txid140961) Found in stem (BTO:0001300). Previous component: stem bark; Methanol-soluble extract of macerated, powdered stem bark See: DOI
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Boehmenan (CHEBI:70672) has role metabolite (CHEBI:25212)
Boehmenan (CHEBI:70672) is a benzofurans (CHEBI:35259)
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:phenylpropanoid(CHEBI:26004); ISA:benzofurans(CHEBI:35259); ISA:cinnamate ester(CHEBI:36087); ISA:hydroxycinnamic acid(CHEBI:24689); ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:olefinic compound(CHEBI:78840); ISA:styrenes(CHEBI:26799); ISA:fatty acid ester(CHEBI:35748); ISA:aromatic ether(CHEBI:35618); ISA:dicarboxylic acid(CHEBI:35692); ISA:enoate ester(CHEBI:51702); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:polyol(CHEBI:26191); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586); ISA:aromatic alcohol(CHEBI:33854);