
API0232742
Abiraterone Acetate
Abiraterone Acetate is used for prostate cancer.
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CAS No.
154229-18-2
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Synonyms
Abiraterone acetate; 154229-18-2; Yonsa
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CHEMBL ID
CHEMBL271227
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Indications
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Molecule Type
Small molecule
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Compound CID
9821849
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Molecular Weight (g/mol)
391.5
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Molecular Formula
C26H33NO2
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InChI
InChI=1S/C26H33NO2/c1-17(28)29-20-10-12-25(2)19(15-20)6-7-21-23-9-8-22(18-5-4-14-27-16-18)26(23,3)13-11-24(21)25/h4-6,8,14,16,20-21,23-24H,7,9-13,15H2,1-3H3/t20-,21-,23-,24-,25-,26+/m0/s1
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InChIKey
UVIQSJCZCSLXRZ-UBUQANBQSA-N
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SMILES
CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC=C4C5=CN=CC=C5)C)C
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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-yl] acetate
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Exact Mass (Da)
391.251129295
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Monoisotopic Mass (Da)
391.251129295
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