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CHEBI:67277 - Brialalepolide B

Default Structure
ChEBI IDCHEBI:67277
ChEBI NameBrialalepolide B
Stars
DefinitionA natural product found in Briareum species.
Last Modified4 September 2015
DownloadsMolfile
FormulaC30H42O11
Net Charge0
Average Mass578.655
Monoisotopic Mass578.27271
SMILES[H][C@@]12[C@H](OC(C)=O)[C@]34O[C@@]3(C)C(=O)O[C@@]4([H])/C=C(/C)[C@H](OC(=O)CCCCC)C[C@H](O)[C@@]1(C)C=C[C@@H](OC(C)=O)[C@@]2(C)O
InChIInChI=1S/C30H42O11/c1-8-9-10-11-23(34)39-19-15-20(33)27(5)13-12-21(37-17(3)31)28(6,36)24(27)25(38-18(4)32)30-22(14-16(19)2)40-26(35)29(30,7)41-30/h12-14,19-22,24-25,33,36H,8-11,15H2,1-7H3/b16-14-/t19-,20+,21-,22+,24-,25+,27-,28-,29+,30+/m1/s1
InChIKeyFRHNNILIALBLSU-XIVSLCBISA-N
Species of MetaboliteComponentSourceComments
Briareum (ncbitaxon:86542) - PubMed (21438584) The CH2Cl2:MeOH (1:1) extract of Briareum sp
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Brialalepolide B (CHEBI:67277) has role metabolite (CHEBI:25212)
Brialalepolide B (CHEBI:67277) is a hexanoate ester (CHEBI:87656)
Citations