Vincamine hydrochloride

Properties Image MNX_ID MNXM162124 reference keggD:D08678 formula C21H27ClN2O3 global charge 0 mol weight 390.911 InChIKey YGKAKNJJNTVSKB-YAFGAGFVSA-N InChI InChI=1S/C21H26N2O3.ClH/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2;/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3;1H/t18-,20+,21+;/m1./s1 SMILES CC[C@@]12CCCN3CCC4=C([C@@H]31)N(C1=CC=CC=C14)[C@@](O)(C(=O)OC)C2.Cl MNX internals InChI (mnx) InChI=1/C21H26N2O3.ClH/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2;/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3;1H/t18-,20+,21+;/m1./s1 SMILES (mnx) [CH3:1][CH2:3][C@@:20]12[CH2:10][CH2:6][CH2:11][N:22]3[CH2:12][CH2:9][C:15]4=[C:17]([C@H:18]13)[N:23]([C:16]1=[CH:8][CH:5]=[CH:4][CH:7]=[C:14]41)[C@:21]([C:19](=[O:24])[O:26][CH3:2])([OH:25])[CH2:13]2.[ClH:27]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0