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Ingredients

Tuberostemonine n

C22H33NO4

Entity Type
Ingredients
Relation Groups
2
Relation Preview
5

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Tuberostemonine n
Molecular Formula
C22H33NO4
Molecular Weight
No data
Canonical SMILES
CCC1C2CCCCN3C2C(CC3C4CC(C(=O)O4)C)C5C1OC(=O)C5C
Isomeric SMILES
CC[C@@H]1[C@H]2CCCCN3[C@H]2[C@H](C[C@H]3[C@@H]4C[C@@H](C(=O)O4)C)[C@@H]5[C@H]1OC(=O)[C@@H]5C
InChI
InChI=1S/C22H33NO4/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/h11-20H,4-10H2,1-3H3/t11-,12+,13+,14+,15+,16-,17-,18+,19+,20-/m0/s1
Oral Bioavailability
15.910
Drug Likeness
0.695
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

herb ingredient1 Herbs
01
百部
Bai Bu / Radix Stemonae; Stemonae Radix
Bai BuRadix Stemonae; Stemonae Radix