01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Decaffeoylacteoside
- Molecular Formula
- C20H30O12
- Molecular Weight
- No data
- Canonical SMILES
- CC1C(C(C(C(O1)OC2C(C(OC(C2O)OCCC3=CC(=C(C=C3)O)O)CO)O)O)O)O
- Isomeric SMILES
- C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2O)OCCC3=CC(=C(C=C3)O)O)CO)O)O)O)O
- InChI
- InChI=1S/C20H30O12/c1-8-13(24)15(26)16(27)20(30-8)32-18-14(25)12(7-21)31-19(17(18)28)29-5-4-9-2-3-10(22)11(23)6-9/h2-3,6,8,12-28H,4-5,7H2,1H3/t8-,12+,13-,14+,15+,16+,17+,18-,19+,20-/m0/s1
- Oral Bioavailability
- 6.335
- Drug Likeness
- 0.196
- 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
牡荆叶
Mu Jing Ye / Viticis Negundo Foliun; Folium Viticis Negundo
Mu Jing YeViticis Negundo Foliun; Folium Viticis Negundo
03
04
玄参
Xuan Shen / Radix Scrophulariae; Scrophulariae Radix
Xuan ShenRadix Scrophulariae; Scrophulariae Radix
05
06
肉苁蓉
Rou Cong Rong / Herba Cistanches; Cistanches Herba
Rou Cong RongHerba Cistanches; Cistanches Herba
07
08