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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24N4O3
Molecular Weight 356.4189
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDROXY DES(BORIC ACID) BORTEZOMIB, (S)-

SMILES

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

InChI

InChIKey=NEIDLJIPMZVISC-RDJZCZTQSA-N
InChI=1S/C19H24N4O3/c1-13(2)10-17(24)23-18(25)15(11-14-6-4-3-5-7-14)22-19(26)16-12-20-8-9-21-16/h3-9,12-13,15,17,24H,10-11H2,1-2H3,(H,22,26)(H,23,25)/t15-,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H24N4O3
Molecular Weight 356.4189
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:12:08 GMT 2023
Edited
by admin
on Sat Dec 16 09:12:08 GMT 2023
Record UNII
BGP3WC2T3P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROXY DES(BORIC ACID) BORTEZOMIB, (S)-
Common Name English
2-PYRAZINECARBOXAMIDE, N-((1S)-2-(((1S)-1-HYDROXY-3-METHYLBUTYL)AMINO)-2-OXO-1-(PHENYLMETHYL)ETHYL)-
Systematic Name English
BORTEZOMIB (M2)
Common Name English
(S)-HYDROXY DES(BORIC ACID) BORTEZOMIB
Common Name English
Code System Code Type Description
PUBCHEM
71607434
Created by admin on Sat Dec 16 09:12:08 GMT 2023 , Edited by admin on Sat Dec 16 09:12:08 GMT 2023
PRIMARY
CAS
289472-81-7
Created by admin on Sat Dec 16 09:12:08 GMT 2023 , Edited by admin on Sat Dec 16 09:12:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID40856381
Created by admin on Sat Dec 16 09:12:08 GMT 2023 , Edited by admin on Sat Dec 16 09:12:08 GMT 2023
PRIMARY
FDA UNII
BGP3WC2T3P
Created by admin on Sat Dec 16 09:12:08 GMT 2023 , Edited by admin on Sat Dec 16 09:12:08 GMT 2023
PRIMARY
Related Record Type Details
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