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CHEBI:202056 - Campyridone B

ChEBI IDCHEBI:202056
ChEBI NameCampyridone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H29NO4
Net Charge0
Average Mass431.532
Monoisotopic Mass431.20966
SMILESCC=C[C@@H]1[C@H]2C[C@@H](C)CC[C@@H]2C(C)=C[C@@]12Oc1c(-c3ccc(O)cc3)cnc(=O)c1C2=O
InChIInChI=1S/C27H29NO4/c1-4-5-22-20-12-15(2)6-11-19(20)16(3)13-27(22)25(30)23-24(32-27)21(14-28-26(23)31)17-7-9-18(29)10-8-17/h4-5,7-10,13-15,19-20,22,29H,6,11-12H2,1-3H3,(H,28,31)/t15-,19+,20-,22+,27+/m0/s1
InChIKeyGEYGPUPQINIUPM-HGSFEQNMSA-N
Species of MetaboliteComponentSourceComments
Campylocarponspecies HDN13-307 (ncbitaxon:1837314) - DOI (10.1016/j.tet.2016.07.080)
ChEBI Ontology
Outgoing Relation(s)
Campyridone B (CHEBI:202056) is a phenylpyridine (CHEBI:38193)
IUPAC Name 
(3S,4aS,5R,6S,8aS)-7'-(4-hydroxyphenyl)-3,8-dimethyl-5-prop-1-enylspiro[2,3,4,4a,5,8a-hexahydro-1H-naphthalene-6,2'-5H-uro[3,2-c]pyridine]-3',4'-dione