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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

D-mandelonitrile

C8H7NO

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
13

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
D-mandelonitrile
Molecular Formula
C8H7NO
Molecular Weight
No data
Canonical SMILES
C1=CC=C(C=C1)C(C#N)O
Isomeric SMILES
C1=CC=C(C=C1)[C@H](C#N)O
InChI
InChI=1S/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H/t8-/m0/s1
Oral Bioavailability
48.261
Drug Likeness
0.586
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
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