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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H25NO5
Molecular Weight 359.4162
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of POSKINE

SMILES

CCC(=O)OC[C@@H](C(=O)O[C@H]1C[C@H]2[C@@H]3O[C@@H]3[C@@H](C1)N2C)C4=CC=CC=C4

InChI

InChIKey=IDTQMAFSZYEUKJ-INRFCZIPSA-N
InChI=1S/C20H25NO5/c1-3-17(22)24-11-14(12-7-5-4-6-8-12)20(23)25-13-9-15-18-19(26-18)16(10-13)21(15)2/h4-8,13-16,18-19H,3,9-11H2,1-2H3/t13-,14-,15-,16+,18-,19+/m1/s1

HIDE SMILES / InChI
Name Type Language
POSKINE
INN  
INN  
Official Name English
poskine [INN]
Preferred Name English
Classification Tree Code System Code
NCI_THESAURUS C29704
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
Code System Code Type Description
FDA UNII
DJ1N20F93D
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY
SMS_ID
100000081390
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY
EPA CompTox
DTXSID201024164
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY
EVMPD
SUB09982MIG
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY
CAS
585-14-8
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY
INN
798
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY
ChEMBL
CHEMBL2105218
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY
NCI_THESAURUS
C75281
Created by admin on Mon Mar 31 18:01:09 GMT 2025 , Edited by admin on Mon Mar 31 18:01:09 GMT 2025
PRIMARY