U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C34H28N4O4
Molecular Weight 556.6105
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CGP-62221

SMILES

[H][C@]12C[C@H]([C@@H](O)[C@](C)(O1)N3C4=CC=CC=C4C5=C3C6=C(C7=CC=CC=C7N26)C8=C5CNC8=O)N(C)C(=O)C9=CC=CC=C9

InChI

InChIKey=PXOCRDZEEXVZQC-AFUPZKSLSA-N
InChI=1S/C34H28N4O4/c1-34-31(39)24(36(2)33(41)18-10-4-3-5-11-18)16-25(42-34)37-22-14-8-6-12-19(22)27-28-21(17-35-32(28)40)26-20-13-7-9-15-23(20)38(34)30(26)29(27)37/h3-15,24-25,31,39H,16-17H2,1-2H3,(H,35,40)/t24-,25-,31-,34+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CGP-62221
Code English
N-((9S,10R,11R,13R)-2,3,10,11,12,13-HEXAHYDRO-10-HYDROXY-9-METHYL-1-OXO-9,13-EPOXY-1H,9H-DIINDOLO(1,2,3-GH:3',2',1'-LM)PYRROLO(3,4-J)(1,7)BENZODIAZONIN-11-YL)-N-METHYLBENZAMIDE
Systematic Name English
BENZAMIDE, N-((9S,10R,11R,13R)-2,3,10,11,12,13-HEXAHYDRO-10-HYDROXY-9-METHYL-1-OXO-9,13-EPOXY-1H,9H-DIINDOLO(1,2,3-GH:3',2',1'-LM)PYRROLO(3,4-J)(1,7)BENZODIAZONIN-11-YL)-N-METHYL-
Systematic Name English
O-DESMETHYL-PKC 412
Code English
CGP62221
Code English
Code System Code Type Description
PUBCHEM
11261445
Created by admin on Sat Dec 16 13:40:03 GMT 2023 , Edited by admin on Sat Dec 16 13:40:03 GMT 2023
PRIMARY
CAS
740816-86-8
Created by admin on Sat Dec 16 13:40:03 GMT 2023 , Edited by admin on Sat Dec 16 13:40:03 GMT 2023
PRIMARY
FDA UNII
H3W3QJ5C7G
Created by admin on Sat Dec 16 13:40:03 GMT 2023 , Edited by admin on Sat Dec 16 13:40:03 GMT 2023
PRIMARY