input word = C00025495

Metabolite InformationStructural formula
Name Harappamine
Formula C27H44N2O
Mw 412.34536404
CAS RN 84679-85-6
C_ID C00025495 ,
InChIKey CQGFNVQPOKZGIV-NUFFQEDFNA-N
InChICode InChI=1S/C27H44N2O/c1-18(28-5)21-12-14-27(4)23-9-8-22-19(15-20(23)11-13-26(21,27)3)7-10-24-25(22,2)16-30-17-29(24)6/h11,15,18,21-24,28H,7-10,12-14,16-17H2,1-6H3/t18-,21-,22-,23-,24+,25-,26-,27+/m1/s1
SMILES CNC(C)[C@H]1CC[C@@]2(C)C3CCC4C(=CC3=CC[C@]12C)CCC1N(C)COC[C@]41C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeBuxus papilosa Ref.
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