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CHEBI:214749 - Curvicollide B

ChEBI IDCHEBI:214749
ChEBI NameCurvicollide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H40O5
Net Charge0
Average Mass432.601
Monoisotopic Mass432.28757
SMILESCC(=O)C(C)C(O)/C=C/C(C)=C/[C@@H]1C(=O)O[C@H](/C(C)=C/C=C/C(C)CCC(C)O)[C@H]1C
InChIInChI=1S/C26H40O5/c1-16(11-13-19(4)27)9-8-10-18(3)25-21(6)23(26(30)31-25)15-17(2)12-14-24(29)20(5)22(7)28/h8-10,12,14-16,19-21,23-25,27,29H,11,13H2,1-7H3/b9-8+,14-12+,17-15+,18-10+/t16?,19?,20?,21-,23-,24?,25+/m0/s1
InChIKeyADWWLOBNTPXVSY-YAWPZOKZSA-N
Species of MetaboliteComponentSourceComments
Pseudoechria curvicolla (ncbitaxon:48157) - PubMed (15070309)
ChEBI Ontology
Outgoing Relation(s)
Curvicollide B (CHEBI:214749) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
(3S,4S,5S)-3-[(1E,3E)-5-hydroxy-2,6-dimethyl-7-oxoocta-1,3-dienyl]-5-[(2E,4E)-9-hydroxy-6-methyldeca-2,4-dien-2-yl]-4-methyloxolan-2-one
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