lupeol
(MQYXUWHLBZFQQO-QGTGJCAVSA-N)
Structure
- SMILES
- CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]1CC[C@H]3[C@@]([C@]1(C)CC2)(C)CC[C@@H]1[C@]3(C)CC[C@@H](C1(C)C)O)C
- Type(s)
- Investigational
- Molecular Formula:
- C30H50O
- Molecular Weight:
- 426.717
- Log P:
- 8.0248
- Hydrogen Bond Acceptor:
- 1
- Hydrogen Bond Donor:
- 1
- TPSA:
- 20.23
- CAS Number(s):
- 545-47-1
Synonym(s)
1.
lupeol
2.
lup-20(29)-en-3-ol
3.
lup-20(29)-en-3beta-ol
4.
lup-20(29)-ene-3alpha-ol
5.
lupeol, (3alpha)-isomer
6.
lupeol, (3beta,18beta,19beta)-isomer
External Link(s)
| MeSH | C010480 |
| PubChem Compound | 259846 |
| BindingDB | 50377927 |
| ChEBI | 6570 |
| CHEMBL | CHEMBL289191 |
| DrugBank | DB12622 |
| KEGG | cpd:C08628 |
| ZINC | 4081455 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Cardiomyopathies | 16259776 | CTD | |
| 2 | Cataract | 26697995 | CTD | |
| 3 | Chromosome Aberrations | 27235710 | CTD | |
| 4 | Hypercholesterolemia | 16933029 | CTD | |
| 5 | Neoplasms, Experimental | 20732907 | CTD | |
| 6 | Skin Neoplasms | 15248479 | CTD | |
| 7 | Wounds and Injuries | 18222664 | CTD |
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