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Ingredients

Periplocin

C36H56O13

Entity Type
Ingredients
Relation Groups
2
Relation Preview
13

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Periplocin
Molecular Formula
C36H56O13
Molecular Weight
No data
Canonical SMILES
CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O
Isomeric SMILES
C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O
InChI
InChI=1S/C36H56O13/c1-18-31(49-32-30(41)29(40)28(39)25(16-37)48-32)24(44-4)14-27(46-18)47-20-5-9-33(2)22-6-10-34(3)21(19-13-26(38)45-17-19)8-12-36(34,43)23(22)7-11-35(33,42)15-20/h13,18,20-25,27-32,37,39-43H,5-12,14-17H2,1-4H3/t18-,20+,21-,22+,23-,24+,25-,27+,28-,29+,30-,31-,32+,33-,34-,35+,36+/m1/s1
Oral Bioavailability
12.231
Drug Likeness
0.164
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 ingredient5 Herbs
01
九里香
Jiu Li Xiang / Folium et Cacumen Murrayae; Murrayae Folium et Cacumen
Jiu Li XiangFolium et Cacumen Murrayae; Murrayae Folium et Cacumen
04
紫苏叶
Zi Su Ye / Folium Perillae; Perillae Folium
Zi Su YeFolium Perillae; Perillae Folium
05
香加皮
Xiang Jia Pi / Cortex Periplocae; Periplocae Cortex
Xiang Jia PiCortex Periplocae; Periplocae Cortex