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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Petroselic acid

C18H34O2

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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
Petroselic acid
Molecular Formula
C18H34O2
Molecular Weight
No data
Canonical SMILES
CCCCCCCCCCCC=CCCCCC(=O)O
Isomeric SMILES
CCCCCCCCCCC/C=C\CCCCC(=O)O
InChI
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h12-13H,2-11,14-17H2,1H3,(H,19,20)/b13-12-
Oral Bioavailability
33.128
Drug Likeness
0.291
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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南鹤虱
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小茴香
Xiao Hui Xiang / Foeniculi Fructus; Fructus Foeniculi
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05
柴胡
Chai Hu / Radix Bupleuri; Bupleuri Radix
Chai HuRadix Bupleuri; Bupleuri Radix
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