Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

Meldenin

C28H38O5

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Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: Meldenin
Molecular Formula: C28H38O5
Molecular Weight: No data
Canonical SMILES: CC(=O)OC1C2C(C(=O)CCC2(C3CCC4(C(CC=C4C3(C1O)C)C5=COC=C5)C)C)(C)C
Isomeric SMILES: CC(=O)O[C@@H]1[C@@H]2[C@](CCC(=O)C2(C)C)([C@H]3CC[C@]4([C@@H](CC=C4C3([C@@H]1O)C)C5=COC=C5)C)C
InChI: InChI=1S/C28H38O5/c1-16(29)33-22-23-25(2,3)21(30)10-13-27(23,5)20-9-12-26(4)18(17-11-14-32-15-17)7-8-19(26)28(20,6)24(22)31/h8,11,14-15,18,20,22-24,31H,7,9-10,12-13H2,1-6H3/t18-,20+,22+,23-,24+,26-,27+,28?/m0/s1
Oral Bioavailability: 15.960
Drug Likeness: 0.476
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

androgen receptor

androgen receptor

03

estrogen receptor 1

estrogen receptor 1

04

3-hydroxy-3-methylglutaryl-CoA reductase

3-hydroxy-3-methylglutaryl-CoA reductase

05

integrin subunit alpha L

integrin subunit alpha L

06

integrin subunit beta 2

integrin subunit beta 2

07

nuclear receptor subfamily 3 group C member 1

nuclear receptor subfamily 3 group C member 1

08

nuclear receptor subfamily 3 group C member 2

nuclear receptor subfamily 3 group C member 2