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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Erucic acid

C22H42O2

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Erucic acid
Molecular Formula
C22H42O2
Molecular Weight
No data
Canonical SMILES
CCCCCCCCC=CCCCCCCCCCCCC(=O)O
Isomeric SMILES
CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O
InChI
InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-
Oral Bioavailability
28.561
Drug Likeness
0.194
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
Related

Related Entities

Direct relations and traceable candidates grouped by relation type.

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板蓝根
Ban Lan Gen / Isatidis Radix; Radix Isatidis
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