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Details

Stereochemistry ABSOLUTE
Molecular Formula C41H64N8O14
Molecular Weight 892.9921
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OM-99-2

SMILES

CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O

InChI

InChIKey=NIOCOJFPGCXNKL-ZKZXETMPSA-N
InChI=1S/C41H64N8O14/c1-20(2)16-27(46-39(60)28(19-31(43)51)47-40(61)34(21(3)4)49-37(58)25(42)12-14-32(52)53)30(50)17-22(5)35(56)44-23(6)36(57)45-26(13-15-33(54)55)38(59)48-29(41(62)63)18-24-10-8-7-9-11-24/h7-11,20-23,25-30,34,50H,12-19,42H2,1-6H3,(H2,43,51)(H,44,56)(H,45,57)(H,46,60)(H,47,61)(H,48,59)(H,49,58)(H,52,53)(H,54,55)(H,62,63)/t22-,23+,25+,26+,27+,28+,29+,30+,34+/m1/s1

HIDE SMILES / InChI

Molecular Formula C41H64N8O14
Molecular Weight 892.9921
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:29 UTC 2023
Edited
by admin
on Sat Dec 16 08:01:29 UTC 2023
Record UNII
4ZNA144ZS0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OM-99-2
Code English
L-PHENYLALANINE, L-.ALPHA.-GLUTAMYL-L-VALYL-L-ASPARAGINYL-(2R,4S,5S)-5-AMINO-4-HYDROXY-2,7-DIMETHYLOCTANOYL-L-ALANYL-L-.ALPHA.-GLUTAMYL-
Systematic Name English
OM99-2
Code English
OM 99-2
Code English
Code System Code Type Description
CAS
314266-76-7
Created by admin on Sat Dec 16 08:01:29 UTC 2023 , Edited by admin on Sat Dec 16 08:01:29 UTC 2023
PRIMARY
PUBCHEM
445649
Created by admin on Sat Dec 16 08:01:29 UTC 2023 , Edited by admin on Sat Dec 16 08:01:29 UTC 2023
PRIMARY
FDA UNII
4ZNA144ZS0
Created by admin on Sat Dec 16 08:01:29 UTC 2023 , Edited by admin on Sat Dec 16 08:01:29 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR