Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

[(2r)-2,3-dihydroxypropyl] (z)-octadec-9-enoate

C21H40O4

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Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 5

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: [(2r)-2,3-dihydroxypropyl] (z)-octadec-9-enoate
Molecular Formula: C21H40O4
Molecular Weight: No data
Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O
Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](CO)O
InChI: InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/t20-/m1/s1
Oral Bioavailability: 34.131
Drug Likeness: 0.208
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

Direct relations and traceable candidates grouped by relation type.

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