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(-)-coronaridine(1+)

PropertiesImage
MNX_IDMNXM1107381 Image of MNXM1107381
referencechebi:146232
formulaC21H27N2O2
global charge1
mol weight339.459
InChIKeyNVVDQMVGALBDGE-PZXGUROGSA-O
InChIInChI=1S/C21H26N2O2/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18/h4-7,13-14,19,22H,3,8-12H2,1-2H3/p+1/t13-,14+,19+,21-/m1/s1
SMILESCC[C@H]1C[C@H]2C[N@@H+]3CCc4c([nH]c5ccccc45)[C@](C(=O)OC)(C2)[C@H]13
MNX internals
InChI (mnx)InChI=1/C21H26N2O2/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18/h4-7,13-14,19,22H,3,8-12H2,1-2H3/t13-,14+,19+,21-/m1/s1 Image of MNXM1107381
SMILES (mnx)[CH3:1][CH2:3][C@H:14]1[CH2:10][C@@H:13]2[CH2:11][C@@:21]3([C:20](=[O:24])[O:25][CH3:2])[c:18]4[c:16]([c:15]5[cH:6][cH:4][cH:5][cH:7][c:17]5[nH:22]4)[CH2:8][CH2:9][N@@:23]([CH2:12]2)[C@@H:19]13
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:146232
chebi:146232
NVVDQMVGALBDGE-PZXGUROGSA-O
(-)-coronaridine(1+)
(-)-coronaridine
18-(methoxycarbonyl)ibogamin-6-ium

CHEBI:3887
chebi:3887
NVVDQMVGALBDGE-PZXGUROGSA-N
(-)-coronaridine
coronaridine
methyl ibogamine-18-carboxylate