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Ingredients

(-)-thebaine

C19H21NO3

Entity Type
Ingredients
Relation Groups
2
Relation Preview
4

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(-)-thebaine
Molecular Formula
C19H21NO3
Molecular Weight
No data
Canonical SMILES
CN1CCC23C4C(=CC=C2C1CC5=C3C(=C(C=C5)OC)O4)OC
Isomeric SMILES
CN1CCC23C4C(=CC=C2C1CC5=C3C(=C(C=C5)OC)O4)OC
InChI
InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3
Oral Bioavailability
No data
Drug Likeness
0.839
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.

Source Herbs

herb ingredient2 Herbs
01
四季青
Si Ji Qing / Ilicis Chinensis Folium; Folium Illics Purpureae
Si Ji QingIlicis Chinensis Folium; Folium Illics Purpureae
02
罂粟壳
Ying Su Qiao / Pericarpium Papaveris; Papaveris Pericarpium
Ying Su QiaoPericarpium Papaveris; Papaveris Pericarpium