(3R)-3-hydroxy-16-methoxy-1,2-didehydro-2,3-dihydrotabersonine
Chemical Formula:
C22H27N2O4
Molecular Weight:
383.466 Daltons
Monoisotopic Mass:
383.1970823655 Daltons
SMILES:
CCC25(C=CC[N+]4(CCC1(C3(C=CC(OC)=CC(N=C1C(C(OC)=O)(O)C2)=3))[CH]45))
InChI:
1S/C22H26N2O4/c1-4-20-8-5-10-24-11-9-21(18(20)24)15-7-6-14(27-2)12-16(15)23-17(21)22(26,13-20)19(25)28-3/h5-8,12,18,26H,4,9-11,13H2,1-3H3/p+1/t18-,20-,21-,22+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-19892
ChEBI:
136640
PubChem (CID):
129011104