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CHEBI:69127 - latrunculol A

ChEBI IDCHEBI:69127
ChEBI Namelatrunculol A
Stars
DefinitionA natural product found in Cacospongia mycofijiensis.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H33NO7S
Net Charge0
Average Mass455.573
Monoisotopic Mass455.19777
SMILES[H][C@@]1([C@@]2(O)C[C@H]3C[C@@H](CC[C@H](C)/C=C\[C@H](O)[C@@H](O)CC/C(C)=C\C(=O)O3)O2)CSC(=O)N1
InChIInChI=1S/C22H33NO7S/c1-13-3-6-15-10-16(11-22(28,30-15)19-12-31-21(27)23-19)29-20(26)9-14(2)5-8-18(25)17(24)7-4-13/h4,7,9,13,15-19,24-25,28H,3,5-6,8,10-12H2,1-2H3,(H,23,27)/b7-4-,14-9-/t13-,15+,16+,17-,18-,19-,22+/m0/s1
InChIKeyJIGPCDTWTJZFFF-HKBWBMOLSA-N
Species of MetaboliteComponentSourceComments
Cacospongia mycofijiensis (ncbitaxon:1162744) - PubMed (22129061)
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)
latrunculol A (CHEBI:69127) has role metabolite (CHEBI:25212)
latrunculol A (CHEBI:69127) is a macrolide (CHEBI:25106)
Synonym  Source
(4R)-4-[(1R,4S,5Z,7S,8S,11Z,15R,17R)-7,8,17-trihydroxy-4,11-dimethyl-13-oxo-14,18-dioxabicyclo[13.3.1]nonadeca-5,11-dien-17-yl]-1,3-thiazolidin-2-oneChEBI
Citations