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abiraterone

Structure via PubChem · Public domain (PubChem)

EntityQ321431· pop 14

abiraterone

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Also known as CB 7598, (3beta)-17-(pyridin-3-yl)androsta-5,16-dien-3-ol, (3β)-17-(pyridin-3-yl)androsta-5,16-dien-3-ol, 17-(3-pyridyl)androsta-5,16-dien-3beta-ol

REDIRECT Abiraterone acetate

Chemical data

Formula
C24H31NO
Molecular weight
349.5 g/mol
IUPAC name
(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol
SMILES
C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4C5=CN=CC=C5)C)O
InChIKey
GZOSMCIZMLWJML-VJLLXTKPSA-N
XLogP
4.6
Polar surface area
33.1 Ų
H-bond donors
1
H-bond acceptors
2
Formal charge
0

via PubChem

Drug data · ChEMBL

Max clinical phase
Approved
Molecule type
Small molecule
Indications
neoplasm, prostate carcinoma, prostate adenocarcinoma, metastatic prostate cancer

via ChEMBL · EBI

Wikidata facts

Mass
349.241
Has use
medication
Show 8 more facts
chemical formula
C₂₄H₃₁NO
canonical SMILES
CC12CCC(CC1=CCC3C2CCC4(C3CC=C4C5=CN=CC=C5)C)O
defined daily dose
1
Commons category
Abiraterone
isomeric SMILES
C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4C5=CN=CC=C5)C)O
World Health Organisation international non-proprietary name
abiraterone
Sources (4)

via Wikidata · CC0

~1 min read

Encyclopedic overview

REDIRECT Abiraterone acetate

Excerpted from Wikipedia’s “abiraterone” article, available under the CC BY-SA 4.0 licence.