PRUNASIN

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

Structure Search

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

Molecular Formula	C14H17NO6
Molecular Weight	295.2879
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:06:51 GMT 2025` Edited by `admin` on `Wed Apr 02 18:06:51 GMT 2025`
Record UNII	14W4BPM5FB
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PRUNASIN

Official Name

English

MANDELONITRILE GLUCOSIDE D-FORM

Preferred 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

Code System Code Type Description

MERCK INDEX

m7054

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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Merck Index

CHEBI

25150

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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MESH

C019063

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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PUBCHEM

119033

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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ECHA (EC/EINECS)

202-738-0

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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EPA CompTox

DTXSID001018995

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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CHEBI

17396

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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CAS

99-18-3

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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WIKIPEDIA

PRUNASIN

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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FDA UNII

14W4BPM5FB

Created by admin on Wed Apr 02 18:06:51 GMT 2025 , Edited by admin on Wed Apr 02 18:06:51 GMT 2025

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