01
侧柏叶
Ce Bai Ye / Platycladi Cacumen; Cacumen Platycladi
Ce Bai YePlatycladi Cacumen; Cacumen Platycladi
Ingredients
3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
C21H20O11
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
- Molecular Formula
- C21H20O11
- Molecular Weight
- No data
- Canonical SMILES
- C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O
- Isomeric SMILES
- C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O
- InChI
- InChI=1S/C21H20O11/c22-7-13-15(25)17(27)19(29)21(32-13)30-10-5-11(24)14-12(6-10)31-20(18(28)16(14)26)8-1-3-9(23)4-2-8/h1-6,13,15,17,19,21-25,27-29H,7H2/t13-,15-,17+,19-,21-/m1/s1
- Oral Bioavailability
- 3.333
- Drug Likeness
- 0.279
- 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.
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herb ingredient8 Herbs
02
天山雪莲
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03
广枣
Guang Zao / Choerospondiatis Fructus; Fructus Choerospondiatis
Guang ZaoChoerospondiatis Fructus; Fructus Choerospondiatis
04
木贼
Mu Zei / Herba Equiseti Hiemalis; Equiseti Hiemalis Herba
Mu ZeiHerba Equiseti Hiemalis; Equiseti Hiemalis Herba
05
06
葶苈子
Ting Li Zi / Semen Lepidii; Semen Descurainiae; Descurainiae Semen Lepidii Semen
Ting Li ZiSemen Lepidii; Semen Descurainiae; Descurainiae Semen Lepidii Semen
07
08