Search MNXref
 Feedback

(1R)-1-(hydroxymethyl)-7-methoxy-2-[(3-methoxyphenyl)methyl]-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

PropertiesImage
MNX_IDMNXM169593 Image of MNXM169593
referencechebi:128844
formulaC27H34N4O4
global charge0
mol weight478.593
InChIKeyKZIDXGDKWGRCPF-QHCPKHFHSA-N
InChIInChI=1S/C27H34N4O4/c1-4-10-28-26(33)31-16-27(17-31)15-30(13-18-6-5-7-19(11-18)34-2)23(14-32)25-24(27)21-9-8-20(35-3)12-22(21)29-25/h5-9,11-12,23,29,32H,4,10,13-17H2,1-3H3,(H,28,33)/t23-/m0/s1
SMILESCCCNC(=O)N1CC2(C1)CN(CC1=CC(OC)=CC=C1)[C@@H](CO)C1=C2C2=C(C=C(OC)C=C2)N1
MNX internals
InChI (mnx)InChI=1/C27H34N4O4/c1-4-10-28-26(33)31-16-27(17-31)15-30(13-18-6-5-7-19(11-18)34-2)23(14-32)25-24(27)21-9-8-20(35-3)12-22(21)29-25/h5-9,11-12,23,29,32H,4,10,13-17H2,1-3H3,(H,28,33)/t23-/m0/s1 Image of MNXM169593
SMILES (mnx)[CH3:1][CH2:4][CH2:10][N:28]=[C:26]([N:31]1[CH2:16][C:27]2([CH2:15][N:30]([CH2:13][C:18]3=[CH:11][C:19]([O:34][CH3:2])=[CH:7][CH:5]=[CH:6]3)[C@@H:23]([CH2:14][OH:32])[C:25]3=[C:24]2[C:21]2=[C:22]([CH:12]=[C:20]([O:35][CH3:3])[CH:8]=[CH:9]2)[NH:29]3)[CH2:17]1)[OH:33]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:128844
chebi:128844
KZIDXGDKWGRCPF-QHCPKHFHSA-N
(1R)-1-(hydroxymethyl)-7-methoxy-2-[(3-methoxyphenyl)methyl]-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide