01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Orixine
- Molecular Formula
- C17H21NO6
- Molecular Weight
- No data
- Canonical SMILES
- CC(C)(C(CC1=C(C2=C(C3=C(C=C2)OCO3)N=C1OC)OC)O)O
- Isomeric SMILES
- CC(C)([C@H](CC1=C(C2=C(C3=C(C=C2)OCO3)N=C1OC)OC)O)O
- InChI
- InChI=1S/C17H21NO6/c1-17(2,20)12(19)7-10-14(21-3)9-5-6-11-15(24-8-23-11)13(9)18-16(10)22-4/h5-6,12,19-20H,7-8H2,1-4H3/t12-/m0/s1
- Oral Bioavailability
- 18.715
- Drug Likeness
- 0.858
- 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.
Source Herbs
herb ingredient8 Herbs
02
03
04
05
06
07
豨莶草
Xi Xian Cao / Siegesbeckiae Herba; Herba Siegesbeckiae
Xi Xian CaoSiegesbeckiae Herba; Herba Siegesbeckiae
08