U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C29H51N5O4.ClH
Molecular Weight 570.207
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DROXINAVIR HYDROCHLORIDE

SMILES

Cl.CNCC(=O)N[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](O)CN(CCC(C)C)C(=O)NC(C)(C)C)C(C)(C)C

InChI

InChIKey=IYKXRORSPVZSHP-ZELIPEIJSA-N
InChI=1S/C29H51N5O4.ClH/c1-20(2)15-16-34(27(38)33-29(6,7)8)19-23(35)22(17-21-13-11-10-12-14-21)31-26(37)25(28(3,4)5)32-24(36)18-30-9;/h10-14,20,22-23,25,30,35H,15-19H2,1-9H3,(H,31,37)(H,32,36)(H,33,38);1H/t22-,23+,25+;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DROXINAVIR HYDROCHLORIDE
USAN  
USAN  
Official Name English
DROXINAVIR HCL
Common Name English
L-VALINAMIDE, N-METHYLGLYCYL-N-(3-((((1,1-DIMETHYLETHYL)AMIN))CARBONYL)(3-METHYLBUTYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-3-METHYL-, MONOHYDROCHLORIDE, (R-(R*,S*))-
Common Name English
3-tert-Butyl-1-[(2R,3S)-3-[(2S)-3,3-dimethyl-2-[2-(methylamino)acetamido]butyramido]-2-hydroxy-4-phenylbutyl]-1-isopentylurea monohydrochloride
Systematic Name English
DROXINAVIR HYDROCHLORIDE [USAN]
Common Name English
SC-55389A
Code English
Classification Tree Code System Code
NCI_THESAURUS C97366
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
Code System Code Type Description
FDA UNII
7QZA627US7
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
PRIMARY
CAS
155662-50-3
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
PRIMARY
NCI_THESAURUS
C72745
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID20935264
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110878
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
PRIMARY
USAN
GG-70
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
PRIMARY
PUBCHEM
9937952
Created by admin on Fri Dec 15 16:09:55 UTC 2023 , Edited by admin on Fri Dec 15 16:09:55 UTC 2023
PRIMARY