01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (s)-coclaurine
- Molecular Formula
- C17H19NO3
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O
- Isomeric SMILES
- COC1=C(C=C2[C@@H](NCCC2=C1)CC3=CC=C(C=C3)O)O
- InChI
- InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1
- Oral Bioavailability
- 42.351
- Drug Likeness
- 0.811
- 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.
Active Targets
ingredient target8 Targets
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