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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H34BN5O5
Molecular Weight 531.411
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2-PYRAZINYLCARBONYL)-L-PHENYLALANYL-N-((1R)-1-BORONO-3-METHYLBUTYL)-L-PHENYLALANINAMIDE

SMILES

CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=NC=CN=C3)B(O)O

InChI

InChIKey=WXSBJLWLFBBGKF-LSQMVHIFSA-N
InChI=1S/C28H34BN5O5/c1-19(2)15-25(29(38)39)34-27(36)23(17-21-11-7-4-8-12-21)32-26(35)22(16-20-9-5-3-6-10-20)33-28(37)24-18-30-13-14-31-24/h3-14,18-19,22-23,25,38-39H,15-17H2,1-2H3,(H,32,35)(H,33,37)(H,34,36)/t22-,23-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H34BN5O5
Molecular Weight 531.411
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 11:02:18 UTC 2023
Edited
by admin
on Sat Dec 16 11:02:18 UTC 2023
Record UNII
HSK5QC9GD2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(2-PYRAZINYLCARBONYL)-L-PHENYLALANYL-N-((1R)-1-BORONO-3-METHYLBUTYL)-L-PHENYLALANINAMIDE
Systematic Name English
L-PHENYLALANINAMIDE, N-(2-PYRAZINYLCARBONYL)-L-PHENYLALANYL-N-((1R)-1-BORONO-3-METHYLBUTYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
HSK5QC9GD2
Created by admin on Sat Dec 16 11:02:18 UTC 2023 , Edited by admin on Sat Dec 16 11:02:18 UTC 2023
PRIMARY
PUBCHEM
124653927
Created by admin on Sat Dec 16 11:02:18 UTC 2023 , Edited by admin on Sat Dec 16 11:02:18 UTC 2023
PRIMARY
CAS
1194235-41-0
Created by admin on Sat Dec 16 11:02:18 UTC 2023 , Edited by admin on Sat Dec 16 11:02:18 UTC 2023
PRIMARY
Related Record Type Details
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