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Details

Stereochemistry EPIMERIC
Molecular Formula C35H53N7O7
Molecular Weight 683.838
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CEP-1612

SMILES

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N[N+]([O-])=O)NC(=O)C(CCCCCCCCN1C(=O)C2=C(C=CC=C2)C1=O)C3CCCC3)C=O

InChI

InChIKey=OOEXUWDNTCTJMI-ZJHKYUCMSA-N
InChI=1S/C35H53N7O7/c1-24(2)22-26(23-43)38-32(45)30(19-13-20-37-35(36)40-42(48)49)39-31(44)27(25-14-8-9-15-25)16-7-5-3-4-6-12-21-41-33(46)28-17-10-11-18-29(28)34(41)47/h10-11,17-18,23-27,30H,3-9,12-16,19-22H2,1-2H3,(H,38,45)(H,39,44)(H3,36,37,40)/t26-,27?,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula C35H53N7O7
Molecular Weight 683.838
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:28:39 GMT 2023
Edited
by admin
on Sat Dec 16 09:28:39 GMT 2023
Record UNII
9K6U075027
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEP-1612
Common Name English
2H-ISOINDOLE-2-DECANAMIDE, .ALPHA.-CYCLOPENTYL-N-((1S)-1-((((1S)-1-FORMYL-3-METHYLBUTYL)AMINO)CARBONYL)-4-((IMINO(NITROAMINO)METHYL)AMINO)BUTYL)-1,3-DIHYDRO-1,3-DIOXO-
Systematic Name English
2H-ISOINDOLE-2-DECANAMIDE, .ALPHA.-CYCLOPENTYL-N-(1-(((1-FORMYL-3-METHYLBUTYL)AMINO)CARBONYL)-4-((IMINO(NITROAMINO)METHYL)AMINO)BUTYL)-1,3-DIHYDRO-1,3-DIOXO-, (N(S(S)))-(PARTIAL)-
Systematic Name English
Code System Code Type Description
CAS
189036-01-9
Created by admin on Sat Dec 16 09:28:39 GMT 2023 , Edited by admin on Sat Dec 16 09:28:39 GMT 2023
PRIMARY
PUBCHEM
9939783
Created by admin on Sat Dec 16 09:28:39 GMT 2023 , Edited by admin on Sat Dec 16 09:28:39 GMT 2023
PRIMARY
FDA UNII
9K6U075027
Created by admin on Sat Dec 16 09:28:39 GMT 2023 , Edited by admin on Sat Dec 16 09:28:39 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY