Search MNXref
 Feedback

LSM-37607

PropertiesImage
MNX_IDMNXM529943 Image of MNXM529943
referencechebi:126040
formulaC26H24N4O3
global charge0
mol weight440.503
InChIKeyGBNDAOCBOQNOMP-ARNLJNQMSA-N
InChIInChI=1S/C26H24N4O3/c31-17-23-25(20-10-8-19(9-11-20)7-6-18-4-2-1-3-5-18)22-15-29(16-24(32)30(22)23)26(33)21-14-27-12-13-28-21/h1-14,22-23,25,31H,15-17H2/t22-,23+,25-/m0/s1
SMILESO=C(C1=NC=CN=C1)N1CC(=O)N2[C@H](CO)[C@@H](C3=CC=C(C=CC4=CC=CC=C4)C=C3)[C@@H]2C1
MNX internals
InChI (mnx)InChI=1/C26H24N4O3/c31-17-23-25(20-10-8-19(9-11-20)7-6-18-4-2-1-3-5-18)22-15-29(16-24(32)30(22)23)26(33)21-14-27-12-13-28-21/h1-14,22-23,25,31H,15-17H2/b7-6?/t22-,23+,25-/m0/s1 Image of MNXM529943
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:18]([CH:6]=[CH:7][C:19]2=[CH:9][CH:11]=[C:20]([C@H:25]3[C@@H:22]4[CH2:15][N:29]([C:26]([C:21]5=[N:28][CH:13]=[CH:12][N:27]=[CH:14]5)=[O:33])[CH2:16][C:24](=[O:32])[N:30]4[C@@H:23]3[CH2:17][OH:31])[CH:10]=[CH:8]2)[CH:5]=[CH:3]1
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:126040
chebi:126040
GBNDAOCBOQNOMP-ARNLJNQMSA-N 		LSM-37607