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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

3beta,23-dihydroxy-oleana-11,13(18)-dien-28-oic acid

C30H46O4

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Entity Type
Ingredients
Relation Groups
4
Relation Preview
18

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
3beta,23-dihydroxy-oleana-11,13(18)-dien-28-oic acid
Molecular Formula
C30H46O4
Molecular Weight
No data
Canonical SMILES
CC1(CCC2(CCC3(C(=C2C1)C=CC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C)C(=O)O)C
Isomeric SMILES
C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2C=CC4=C5CC(CC[C@@]5(CC[C@]43C)C(=O)O)(C)C)C)(C)CO)O
InChI
InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7-8,21-23,31-32H,9-18H2,1-6H3,(H,33,34)/t21-,22-,23+,26+,27+,28-,29-,30+/m1/s1
Oral Bioavailability
21.530
Drug Likeness
0.454
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