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

Details

Stereochemistry ABSOLUTE
Molecular Formula C36H47N5O4.C2H6O.H2O4S
Molecular Weight 757.936
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of INDINAVIR SULFATE ETHANOLATE

SMILES

CCO.OS(O)(=O)=O.CC(C)(C)NC(=O)[C@@H]1CN(CC2=CN=CC=C2)CCN1C[C@@H](O)C[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H]4[C@H](O)CC5=C4C=CC=C5

InChI

InChIKey=QDNVAYDEAGXHTB-NOYQBWMBSA-N
InChI=1S/C36H47N5O4.C2H6O.H2O4S/c1-36(2,3)39-35(45)31-24-40(22-26-12-9-15-37-21-26)16-17-41(31)23-29(42)19-28(18-25-10-5-4-6-11-25)34(44)38-33-30-14-8-7-13-27(30)20-32(33)43;1-2-3;1-5(2,3)4/h4-15,21,28-29,31-33,42-43H,16-20,22-24H2,1-3H3,(H,38,44)(H,39,45);3H,2H2,1H3;(H2,1,2,3,4)/t28-,29+,31+,32-,33+;;/m1../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
INDINAVIR SULFATE ETHANOLATE
JAN  
Common Name English
INDINAVIR SULFATE [EP MONOGRAPH]
Common Name English
INDINAVIR SULFATE ETHANOLATE [JAN]
Common Name English
Code System Code Type Description
FDA UNII
34OB95C8AE
Created by admin on Sat Dec 16 01:41:09 UTC 2023 , Edited by admin on Sat Dec 16 01:41:09 UTC 2023
PRIMARY
PUBCHEM
11954281
Created by admin on Sat Dec 16 01:41:09 UTC 2023 , Edited by admin on Sat Dec 16 01:41:09 UTC 2023
PRIMARY
SMS_ID
100000176917
Created by admin on Sat Dec 16 01:41:09 UTC 2023 , Edited by admin on Sat Dec 16 01:41:09 UTC 2023
PRIMARY