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Ingredients

11-hydroxy-14,15alpha-epoxytabersonine

C21H24N2O4

Entity Type
Ingredients
Relation Groups
2
Relation Preview
10

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
11-hydroxy-14,15alpha-epoxytabersonine
Molecular Formula
C21H24N2O4
Molecular Weight
No data
Canonical SMILES
CCC12CC(=C3C4(C1N(CC4)CC5C2O5)C6=C(N3)C=C(C=C6)O)C(=O)OC
Isomeric SMILES
CCC12CC(=C3[C@@]4(C1N(CC4)CC5C2O5)C6=C(N3)C=C(C=C6)O)C(=O)OC
InChI
InChI=1S/C21H24N2O4/c1-3-20-9-12(18(25)26-2)16-21(13-5-4-11(24)8-14(13)22-16)6-7-23(19(20)21)10-15-17(20)27-15/h4-5,8,15,17,19,22,24H,3,6-7,9-10H2,1-2H3/t15?,17?,19?,20?,21-/m0/s1
Oral Bioavailability
13.472
Drug Likeness
0.615
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.

Active Targets

ingredient target7 Targets
02
CHRM3
cholinergic receptor muscarinic 3
cholinergic receptor muscarinic 3
06
PTGS2
prostaglandin-endoperoxide synthase 2
prostaglandin-endoperoxide synthase 2
07
SCN5A
sodium voltage-gated channel alpha subunit 5
sodium voltage-gated channel alpha subunit 5