Name: Abiraterone Related Compound 7
Brand: Chemat Brand
SKU: ULA8229

brand	Chemat Brand
catalog number	ULA8229
cas	186826-68-6
size	on request
availability	Do potwierdzenia przez Chemat\|To be confirmed by Chemat

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purity	No data
category	Chemicals
delivery time	To be confirmed by Chemat

2D
3D

[(3S,8R,9S,10R,13S,14S)-17-[(3S,8R,9S,10R,13S,14S)-3-acetyloxy-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate (CAS 186826-68-6) is a chemical compound with the molecular formula C47H61NO4 and a molecular weight of 704.0 g/mol. IUPAC name: [(3S,8R,9S,10R,13S,14S)-17-[(3S,8R,9S,10R,13S,14S)-3-acetyloxy-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate. InChIKey: LFPGBQAWACWPBR-NBDAZIKLSA-N.

Identity
Molecular formula	C₄₇H₆₁NO₄
Molecular weight	704.0 g/mol
IUPAC name	[(3S,8R,9S,10R,13S,14S)-17-[(3S,8R,9S,10R,13S,14S)-3-acetyloxy-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
InChIKey	LFPGBQAWACWPBR-NBDAZIKLSA-N
SMILES	CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC=C4C5=C([C@]6(CC[C@H]7[C@H]([C@@H]6C5)CC=C8[C@@]7(CC[C@@H](C8)OC(=O)C)C)C)C9=CN=CC=C9)C)C

Computed by PubChem (NCBI)

Synonyms: Abiraterone Related Compound 7

Also listed as

Abiraterone Impurity 53 Chemat Brand CAS 186826-68-6

Abiraterone Impurity 31 Hubei YoungXin CAS 186826-68-6

Abiraterone Acetate Dimer , >95% (HPLC) TRC CAS 186826-68-6