Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

Bisdehydroneotuberostemonine

C22H29NO4

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Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 14

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: Bisdehydroneotuberostemonine
Molecular Formula: C22H29NO4
Molecular Weight: No data
Canonical SMILES: CCC1C2CCCCN3C2=C(C=C3C4CC(C(=O)O4)C)C5C1OC(=O)C5C
Isomeric SMILES: CCC1C2CCCCN3C2=C(C=C3C4CC(C(=O)O4)C)C5C1OC(=O)C5C
InChI: InChI=1S/C22H29NO4/c1-4-13-14-7-5-6-8-23-16(17-9-11(2)21(24)26-17)10-15(19(14)23)18-12(3)22(25)27-20(13)18/h10-14,17-18,20H,4-9H2,1-3H3
Oral Bioavailability: 51.136
Drug Likeness: 0.736
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 Active Targets

Active Targets

ingredient target8 Targets

Graph More Targets

01

adrenoceptor alpha 1A

adrenoceptor alpha 1A

02

adrenoceptor alpha 1B

adrenoceptor alpha 1B

03

adrenoceptor alpha 1D

adrenoceptor alpha 1D

04

adrenoceptor beta 2

adrenoceptor beta 2

05

androgen receptor

androgen receptor

06

cholinergic receptor muscarinic 1

cholinergic receptor muscarinic 1

07

cholinergic receptor muscarinic 2

cholinergic receptor muscarinic 2

08

cholinergic receptor muscarinic 3

cholinergic receptor muscarinic 3