CHEBI:69127 - latrunculol A

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name latrunculol A
ChEBI ID CHEBI:69127
Definition A natural product found in Cacospongia mycofijiensis.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H33NO7S
Net Charge 0
Average Mass 455.56500
Monoisotopic Mass 455.19777
InChI InChI=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
InChIKey JIGPCDTWTJZFFF-HKBWBMOLSA-N
SMILES [H][C@]1(CSC(=O)N1)[C@@]1(O)C[C@H]2C[C@@H](CC[C@H](C)\C=C/[C@H](O)[C@@H](O)CC\C(C)=C/C(=O)O2)O1
Metabolite of Species Details
Cacospongia mycofijiensis (NCBI:txid1162744) 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 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-one ChEBI
Citation Waiting for Citations Type Source
22129061 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:oxanes(CHEBI:46942); ISA:enoate ester(CHEBI:51702); ISA:thiazolidines(CHEBI:35622); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:secondary alcohol(CHEBI:35681); ISA:hemiacetal(CHEBI:5653); ISA:lactone(CHEBI:25000); ISA:polyol(CHEBI:26191); ISA:organic sulfide(CHEBI:16385); ISA:monocarboxylic acid(CHEBI:25384); ISA:amine(CHEBI:32952); ISA:carbonyl compound(CHEBI:36586);