DIHYDROBETULINIC ACID [21411]
DIHYDROBETULINIC ACID
| SMILES |
CC(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12 |
| InChIKey |
PZXJOHSZQAEJFE-UOTMTCHLSA-N |
Chemical Properties
| Hydrogen bond acceptors |
2 |
| Hydrogen bond donors |
2 |
| Rotatable bonds |
2 |
| Log P |
7.169 |
| Molecular weight (Da) |
458.4 |
| Stereochemistry info |
partial |
Bioactivities
|
| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
Database |
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
Database |
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Drug properties
| Molecular type |
Small molecule |
| Physiological/Surrogate |
Surrogate |
| Approved drug |
No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0
Compound is not listed as a drug.