CHEBI:68062 - kabiramide B

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ChEBI Name kabiramide B
ChEBI ID CHEBI:68062
Definition A natural product found in Pachastrissa nux.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C47H69N5O14
Net Charge 0
Average Mass 928.07590
Monoisotopic Mass 927.48410
InChI InChI=1S/C47H69N5O14/c1-26-18-32(65-47(48)58)20-42(57)66-40(21-39(59-8)27(2)14-15-37(55)30(5)43(60-9)28(3)16-17-52(7)25-53)29(4)36(54)12-11-13-41-49-34(23-62-41)45-51-35(24-64-45)46-50-33(22-63-46)44(61-10)31(6)38(56)19-26/h11,13,16-17,22-32,36,38-40,43-44,54,56H,12,14-15,18-21H2,1-10H3,(H2,48,58)/b13-11+,17-16+/t26-,27-,28+,29+,30-,31-,32-,36-,38-,39-,40-,43+,44+/m0/s1
InChIKey SVDMAXBQMZIUPX-QSPXEARGSA-N
SMILES CO[C@@H](C[C@@H]1OC(=O)C[C@H](C[C@H](C)C[C@H](O)[C@H](C)[C@@H](OC)c2coc(n2)-c2coc(n2)-c2coc(\C=C\C[C@H](O)[C@H]1C)n2)OC(N)=O)[C@@H](C)CCC(=O)[C@H](C)[C@H](OC)[C@H](C)\C=C\N(C)C=O
Metabolite of Species Details
Pachastrissa nux (WORMS:555791) Methanolic extract of macerated sponge specimens 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 kabiramide B (CHEBI:68062) has role metabolite (CHEBI:25212)
kabiramide B (CHEBI:68062) is a diterpene lactone (CHEBI:49193)
Citation Waiting for Citations Type Source
21410162 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:diterpenoid(CHEBI:23849); ISA:macrolide(CHEBI:25106); ISA:2-oxo aldehyde(CHEBI:27659); ISA:carbamate ester(CHEBI:23003); ISA:oxazole(CHEBI:35790); ISA:carboxamide(CHEBI:37622); ISA:carboxylic ester(CHEBI:33308); ISA:secondary alcohol(CHEBI:35681); ISA:ketone(CHEBI:17087); ISA:tertiary amine(CHEBI:32876); ISA:lactone(CHEBI:25000); ISA:ether(CHEBI:25698); ISA:carboxylic acid(CHEBI:33575); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:enamine(CHEBI:47989);