input word = C00024853

Metabolite InformationStructural formula
Name Contorine
Formula C31H35NO7
Mw 533.24135248
CAS RN 144398-38-9
C_ID C00024853 ,
InChIKey ZYAZOLHJSNQEDA-UHFFFAOYNA-N
InChICode InChI=1S/C31H35NO7/c1-15-11-30-12-20(34)25-29(3)14-32(4)26-23(30)24(35)19(15)10-22(30)31(25,26)13-21(38-16(2)33)27(29)39-28(36)17-6-8-18(37-5)9-7-17/h6-9,19,21-23,25-27H,1,10-14H2,2-5H3/t19-,21+,22+,23+,25+,26+,27-,29-,30+,31+/m0/s1
SMILES C=C1CC23CC(=O)C4C5(C)CN(C)C6C2C(=O)C1CC3C64CC(OC(C)=O)C5OC(=O)c1ccc(OC)cc1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum contortum Ref.
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OrganismAconitum contortum
ReferenceNitsu,Heterocycles,34,(1992),1231