Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

Xanthoplanine

C21H26NO4+

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Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 13

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: Xanthoplanine
Molecular Formula: C21H26NO4+
Molecular Weight: No data
Canonical SMILES: C[N+]1(CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)O)OC)OC)C
Isomeric SMILES: C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)OC)C
InChI: InChI=1S/C21H25NO4/c1-22(2)7-6-12-10-18(25-4)21(26-5)20-14-11-17(24-3)16(23)9-13(14)8-15(22)19(12)20/h9-11,15H,6-8H2,1-5H3/p+1/t15-/m0/s1
Oral Bioavailability: 6.864
Drug Likeness: 0.857
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

acetylcholinesterase (Cartwright blood group)

acetylcholinesterase (Cartwright blood group)

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

checkpoint kinase 1

checkpoint kinase 1

07

cholinergic receptor muscarinic 1

cholinergic receptor muscarinic 1

08

cholinergic receptor muscarinic 3

cholinergic receptor muscarinic 3