01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 8
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Jervine
- Molecular Formula
- C27H39NO3
- Molecular Weight
- No data
- Canonical SMILES
- CC1CC2C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5C(=O)C4=C3C)C)O)C)NC1
- Isomeric SMILES
- C[C@H]1C[C@@H]2[C@H]([C@H]([C@]3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5C(=O)C4=C3C)C)O)C)NC1
- InChI
- InChI=1S/C27H39NO3/c1-14-11-21-24(28-13-14)16(3)27(31-21)10-8-19-20-6-5-17-12-18(29)7-9-26(17,4)23(20)25(30)22(19)15(27)2/h5,14,16,18-21,23-24,28-29H,6-13H2,1-4H3/t14-,16+,18-,19-,20-,21+,23+,24-,26-,27-/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.572
- 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 ingredient5 Herbs
02
03
04
05
藜芦
Li Lu / Radix et Rhizoma Veratri Nigri.; Radix et Rhizoma Veratri Schindler.; Radix et Rhizoma Veratri Maackii.; Radix et Rhizoma Veratri Dahurici.; Radix et Rhizoma Veratri Grandiflori.
Li LuRadix et Rhizoma Veratri Nigri.; Radix et Rhizoma Veratri Schindler.; Radix et Rhizoma Veratri Maackii.; Radix et Rhizoma Veratri Dahurici.; Radix et Rhizoma Veratri Grandiflori.