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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H17NO6
Molecular Weight 295.2879
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRUNASIN

SMILES

OC[C@H]1O[C@@H](O[C@@H](C#N)C2=CC=CC=C2)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=ZKSZEJFBGODIJW-GMDXDWKASA-N
InChI=1S/C14H17NO6/c15-6-9(8-4-2-1-3-5-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-5,9-14,16-19H,7H2/t9-,10+,11+,12-,13+,14+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
PRUNASIN
INCI  
INCI  
Official Name English
PRUNASIN [INCI]
Common Name English
MANDELONITRILE GLUCOSIDE D-FORM [MI]
Common Name English
BENZENEACETONITRILE, .ALPHA.-(.BETA.-D-GLUCOPYRANOSYLOXY)-, (R)-
Common Name English
BENZENEACETONITRILE, .ALPHA.-(.BETA.-D-GLUCOPYRANOSYLOXY)-, (.ALPHA.R)-
Common Name English
(2R)-PRUNASIN
Common Name English
(R)-PRUNASIN
Common Name English
D-PRUNASIN
Common Name English
MANDELONITRILE GLUCOSIDE D-FORM
MI  
Common Name English
Code System Code Type Description
MERCK INDEX
m7054
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY Merck Index
CHEBI
25150
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
MESH
C019063
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
PUBCHEM
119033
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-738-0
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
CHEBI
17396
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
CAS
99-18-3
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
WIKIPEDIA
PRUNASIN
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
FDA UNII
14W4BPM5FB
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID00101899
Created by admin on Sat Dec 16 20:02:18 GMT 2023 , Edited by admin on Sat Dec 16 20:02:18 GMT 2023
PRIMARY