stemmadenine
Chemical Formula:
C21H27N2O3
Molecular Weight:
355.456 Daltons
Monoisotopic Mass:
355.2021677434 Daltons
SMILES:
CC=C3(C[N+]4(CCC2(C1(C=CC=CC=1NC=2C(C(OC)=O)(CO)[CH]3CC4))))
InChI:
1S/C21H26N2O3/c1-3-14-12-23-10-8-16-15-6-4-5-7-18(15)22-19(16)21(13-24,20(25)26-2)17(14)9-11-23/h3-7,17,22,24H,8-13H2,1-2H3/p+1/b14-3-/t17-,21-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-21546
ChemSpider:
8242264
ChEBI:
142674
PubChem (CID):
135397962