CHEBI:67741 - (6Z)-neomanoalide

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ChEBI Name (6Z)-neomanoalide
ChEBI ID CHEBI:67741
Definition A natural product found in Hippospongia lachne.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H38O4
Net Charge 0
Average Mass 402.56680
Monoisotopic Mass 402.27701
InChI InChI=1S/C25H38O4/c1-18(10-12-22-19(2)8-6-14-25(22,3)4)7-5-9-20(16-26)11-13-23-21(17-27)15-24(28)29-23/h7,11,15,23,26-27H,5-6,8-10,12-14,16-17H2,1-4H3/b18-7+,20-11-/t23-/m1/s1
InChIKey VOZHIXNCTBMKNV-JTASSXHHSA-N
SMILES C\C(CCC1=C(C)CCCC1(C)C)=C/CC\C(CO)=C\C[C@H]1OC(=O)C=C1CO
Metabolite of Species Details
Hippospongia lachne (NCBI:txid479639) 95% aqueous ethanolic extract of dried sponge 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (6Z)-neomanoalide (CHEBI:67741) has role metabolite (CHEBI:25212)
(6Z)-neomanoalide (CHEBI:67741) is a diterpene lactone (CHEBI:49193)
Synonym Source
(2R)-3-(hydroxymethyl)-2-[(2Z,6E)-3-(hydroxymethyl)-7-methyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,6-dienyl]-2H-furan-5-one ChEBI
Citation Waiting for Citations Type Source
21548579 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:diterpenoid(CHEBI:23849); ISA:aliphatic alcohol(CHEBI:2571); ISA:butenolide(CHEBI:50523); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enoate ester(CHEBI:51702); ISA:lactone(CHEBI:25000); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:carbonyl compound(CHEBI:36586); ISA:primary alcohol(CHEBI:15734);