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Ingredients

Sinapine bisulfate

C16H25NO9S

Entity Type
Ingredients
Relation Groups
2
Relation Preview
10

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Sinapine bisulfate
Molecular Formula
C16H25NO9S
Molecular Weight
No data
Canonical SMILES
C[N+](C)(C)CCOC(=O)C=CC1=CC(=C(C(=C1)OC)O)OC.OS(=O)(=O)[O-]
Isomeric SMILES
C[N+](C)(C)CCOC(=O)/C=C/C1=CC(=C(C(=C1)OC)O)OC.OS(=O)(=O)[O-]
InChI
InChI=1S/C16H23NO5.H2O4S/c1-17(2,3)8-9-22-15(18)7-6-12-10-13(20-4)16(19)14(11-12)21-5;1-5(2,3)4/h6-7,10-11H,8-9H2,1-5H3;(H2,1,2,3,4)
Oral Bioavailability
No data
Drug Likeness
0.219
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 ingredient2 Herbs
02
黄芩
Huang Qin / Radix Scutellariae; Scutellariae Radix
Huang QinRadix Scutellariae; Scutellariae Radix