
API0232733
Ulipristal Acetate
Ulipristal Acetate is a progesterone receptor modulator used for uterine fibroids and emergency contraception.
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CAS No.
126784-99-4
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Synonyms
Ulipristal acetate; 126784-99-4; Ella
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CHEMBL ID
CHEMBL260538
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Indications
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Molecule Type
Small molecule
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Compound CID
130904
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Molecular Weight (g/mol)
475.6
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Molecular Formula
C30H37NO4
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InChI
InChI=1S/C30H37NO4/c1-18(32)30(35-19(2)33)15-14-27-25-12-8-21-16-23(34)11-13-24(21)28(25)26(17-29(27,30)3)20-6-9-22(10-7-20)31(4)5/h6-7,9-10,16,25-27H,8,11-15,17H2,1-5H3/t25-,26+,27-,29-,30-/m0/s1
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InChIKey
OOLLAFOLCSJHRE-ZHAKMVSLSA-N
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SMILES
CC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CC[C@@H]23)C5=CC=C(C=C5)N(C)C)C)OC(=O)C
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IUPAC Name
[(8S,11R,13S,14S,17R)-17-acetyl-11-[4-(dimethylamino)phenyl]-13-methyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate
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Exact Mass (Da)
475.27225866
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Monoisotopic Mass (Da)
475.27225866
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