Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C30H48O3
- Molecular weight
- 456.7 g/mol
- IUPAC name
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid
- SMILES
- CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C(=O)O
- InChIKey
- QGJZLNKBHJESQX-FZFNOLFKSA-N
- XLogP
- 8.2
- Polar surface area
- 57.5 Ų
- H-bond donors
- 2
- H-bond acceptors
- 3
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Max clinical phase
- Phase 1
- Molecule type
- Small molecule
- Indications
- melanoma, dysplastic nevus
via ChEMBL · EBI
Research
2,595 papers- Betulinic Acid for Glioblastoma Treatment: Reality, Challenges and Perspectives.International journal of molecular sciences · 2024
- Betulinic acid: A natural promising anticancer drug, current situation, and future perspectives.Journal of biochemical and molecular toxicology · 2022
- Advancements in Betulinic Acid-Loaded Nanoformulations for Enhanced Anti-Tumor Therapy.International journal of nanomedicine · 2024
- Betulinic acid in the treatment of tumour diseases: Application and research progress.Biomedicine & pharmacotherapy = Biomedecine & pharmacotherapie · 2021
- A Review on Preparation of Betulinic Acid and Its Biological Activities.Molecules (Basel, Switzerland) · 2021
via PubMed
Wikidata facts
- Subclass of
- carboxylic acid
- Has part
- carbon
- Mass
- 456.360345
Show 6 more facts
- chemical formula
- C₃₀H₄₈O₃
- found in taxon
- Salvia officinalis
- Commons category
- Betulinic acid
- isomeric SMILES
- CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C(=O)O
- canonical SMILES
- CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O
- subject has role
- bactericide
via Wikidata · CC0