Estradiol butyrylacetate

Estradiol butyrylacetate
Identifiers
	IUPAC name [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 3-oxohexanoate;
CAS Number	60883-80-9;
PubChem CID	91667672;
ChemSpider	52084153;
UNII	6ADI485E6C;
Chemical and physical data
Formula	C24H32O4
Molar mass	384.52 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES CCCC(=O)CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C;
	InChI InChI=1S/C24H32O4/c1-3-4-16(25)14-23(27)28-22-10-9-21-20-7-5-15-13-17(26)6-8-18(15)19(20)11-12-24(21,22)2/h6,8,13,19-22,26H,3-5,7,9-12,14H2,1-2H3/t19-,20-,21+,22+,24+/m1/s1; Key:LLWMXKOTHFASEO-NTYLBUJVSA-N;

Estradiol butyrylacetate (brand name Follikoside), also known as 17-butanoylacetylestradiol, is a semisynthetic, steroidal estrogen.^[1] It is an estrogen ester, specifically, an ester of estradiol.^[1]

References

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Identifiers

IUPAC name [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 3-oxohexanoate
CAS Number	60883-80-9
PubChem CID	91667672
ChemSpider	52084153
UNII	6ADI485E6C
Chemical and physical data
Formula	C₂₄H₃₂O₄
Molar mass	384.52 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES CCCC(=O)CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C
InChI InChI=1S/C24H32O4/c1-3-4-16(25)14-23(27)28-22-10-9-21-20-7-5-15-13-17(26)6-8-18(15)19(20)11-12-24(21,22)2/h6,8,13,19-22,26H,3-5,7,9-12,14H2,1-2H3/t19-,20-,21+,22+,24+/m1/s1 Key:LLWMXKOTHFASEO-NTYLBUJVSA-N