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Ingredients

(24r)-4alpha-methyl-24-ethylcholesta-7,25-dien-3beta-ylacetate

C33H54O2

Entity Type
Ingredients
Relation Groups
2
Relation Preview
4

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(24r)-4alpha-methyl-24-ethylcholesta-7,25-dien-3beta-ylacetate
Molecular Formula
C33H54O2
Molecular Weight
No data
Canonical SMILES
CCC(CCC(C)C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4C)OC(=O)C)C)C)C)C(=C)C
Isomeric SMILES
CCC(CCC(C)[C@H]1CCC2([C@@]1(CCC3C2=CCC4[C@@]3(CC[C@@H](C4C)OC(=O)C)C)C)C)C(=C)C
InChI
InChI=1S/C33H54O2/c1-10-25(21(2)3)12-11-22(4)26-15-19-33(9)29-14-13-27-23(5)30(35-24(6)34)17-18-31(27,7)28(29)16-20-32(26,33)8/h14,22-23,25-28,30H,2,10-13,15-20H2,1,3-9H3/t22?,23?,25?,26-,27?,28?,30+,31+,32-,33?/m1/s1
Oral Bioavailability
46.357
Drug Likeness
0.267
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 ingredient3 Herbs
01
断血流
Duan Xue Liu / Clinopodii Herba; Herba Clinopodii
Duan Xue LiuClinopodii Herba; Herba Clinopodii