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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H41N5O6
Molecular Weight 603.7085
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CE-2072

SMILES

CC(C)[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](C(C)C)C(=O)C3=NN=C(CC4=CC=CC(C)=C4)O3

InChI

InChIKey=FPGAGACTKJTPFT-MYKRZTLLSA-N
InChI=1S/C33H41N5O6/c1-20(2)27(29(39)31-37-36-26(44-31)18-24-14-9-11-22(5)17-24)34-30(40)25-15-10-16-38(25)32(41)28(21(3)4)35-33(42)43-19-23-12-7-6-8-13-23/h6-9,11-14,17,20-21,25,27-28H,10,15-16,18-19H2,1-5H3,(H,34,40)(H,35,42)/t25-,27-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C33H41N5O6
Molecular Weight 603.7085
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:22:15 GMT 2023
Edited
by admin
on Sat Dec 16 09:22:15 GMT 2023
Record UNII
X4EDB9177R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CE-2072
Common Name English
L-PROLINAMIDE, N-((PHENYLMETHOXY)CARBONYL)-L-VALYL-N-((1S)-2-METHYL-1-((5-((3-METHYLPHENYL)METHYL)-1,3,4-OXADIAZOL-2-YL)CARBONYL)PROPYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9808874
Created by admin on Sat Dec 16 09:22:16 GMT 2023 , Edited by admin on Sat Dec 16 09:22:16 GMT 2023
PRIMARY
FDA UNII
X4EDB9177R
Created by admin on Sat Dec 16 09:22:16 GMT 2023 , Edited by admin on Sat Dec 16 09:22:16 GMT 2023
PRIMARY
CAS
208840-22-6
Created by admin on Sat Dec 16 09:22:16 GMT 2023 , Edited by admin on Sat Dec 16 09:22:16 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY