Estrone tetraacetylglucoside

Estrone tetraacetylglucoside
Identifiers
	IUPAC name [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-{[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy}oxan-2-yl]methyl acetate;
CAS Number	27610-08-8;
PubChem CID	102146562;
ChemSpider	26594301;
CompTox Dashboard (EPA)	DTXSID901046420 ;
Chemical and physical data
Formula	C32H40O11
Molar mass	600.661 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES CC(=O)OCC1OC(Oc2ccc3C4CCC5(C)C(CCC5=O)C4CCc3c2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O;
	InChI InChI=1S/C32H40O11/c1-16(33)38-15-26-28(39-17(2)34)29(40-18(3)35)30(41-19(4)36)31(43-26)42-21-7-9-22-20(14-21)6-8-24-23(22)12-13-32(5)25(24)10-11-27(32)37/h7,9,14,23-26,28-31H,6,8,10-13,15H2,1-5H3; Key:IMZSXCARTLIDBP-UHFFFAOYSA-N;

Estrone tetraacetylglucoside (brand name Glucovex, Glycovex) is a semisynthetic, steroidal estrogen.^[1] It is an estrogen ester, specifically, an ester of estrone.^[1] The drug was marketed since at least 1942.^[2]

References

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Identifiers

IUPAC name [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-{[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy}oxan-2-yl]methyl acetate
CAS Number	27610-08-8
PubChem CID	102146562
ChemSpider	26594301
CompTox Dashboard (EPA)	DTXSID901046420
Chemical and physical data
Formula	C₃₂H₄₀O₁₁
Molar mass	600.661 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES CC(=O)OCC1OC(Oc2ccc3C4CCC5(C)C(CCC5=O)C4CCc3c2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
InChI InChI=1S/C32H40O11/c1-16(33)38-15-26-28(39-17(2)34)29(40-18(3)35)30(41-19(4)36)31(43-26)42-21-7-9-22-20(14-21)6-8-24-23(22)12-13-32(5)25(24)10-11-27(32)37/h7,9,14,23-26,28-31H,6,8,10-13,15H2,1-5H3 Key:IMZSXCARTLIDBP-UHFFFAOYSA-N