CHEBI:3861 - Conocurvone

ChEBI IDCHEBI:3861
ChEBI NameConocurvone
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC60H56O11
Net Charge0
Average Mass953.097
Monoisotopic Mass952.38226
SMILESCC(C)=CCC[C@]1(C)C=Cc2c(ccc3c2C(=O)C(O)=C(C2=C(C4=C(O)C(=O)c5c(ccc6c5C=C[C@@](C)(CCC=C(C)C)O6)C4=O)C(=O)c4c(ccc5c4C=C[C@@](C)(CCC=C(C)C)O5)C2=O)C3=O)O1
InChIInChI=1S/C60H56O11/c1-31(2)13-10-25-58(7)28-22-34-40(69-58)19-16-37-43(34)53(64)47(49-52(63)39-18-21-42-36(45(39)55(66)57(49)68)24-30-60(9,71-42)27-12-15-33(5)6)46(50(37)61)48-51(62)38-17-20-41-35(44(38)54(65)56(48)67)23-29-59(8,70-41)26-11-14-32(3)4/h13-24,28-30,67-68H,10-12,25-27H2,1-9H3/t58-,59-,60-/m1/s1
InChIKeyIJDNMADFCZSLQD-UPMPAGDASA-N
ChEBI Ontology
Outgoing Relation(s)
Conocurvone (CHEBI:3861) is a organic heterotricyclic compound (CHEBI:26979)
Conocurvone (CHEBI:3861) is a organooxygen compound (CHEBI:36963)
Synonym  Source
ConocurvoneKEGG COMPOUND
Manual XrefsDatabases
C10318KEGG COMPOUND
C00002809KNApSAcK
Registry NumbersSources
CAS:149572-31-6KEGG COMPOUND