17 Alpha-ethynylestradiol-17 beta-D-glucopyranosiduronic acid

CAS
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CAS
75803-39-3
Size
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Purity
96%
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Catalog Number

ACM75803393

Product Name

17 Alpha-ethynylestradiol-17 beta-D-glucopyranosiduronic acid

Structure

CAS

75803-39-3

Category

Heterocyclic Organic Compound

Synonyms

(17α)-3-Hydroxy-19-norpregna-1,3,5(10)-trien-20-yn-17-yl β-D-Glucopyranosiduronic Acid;

IUPAC Name

(2S,3S,4S,5R,6S)-6-[[(13S)-17-ethynyl-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Molecular Weight

472.53

Molecular Formula

C₂₆H₃₂O₈

Canonical SMILES

CC12CCC3C(C1CCC2(C#C)OC4C(C(C(C(O4)C(=O)O)O)O)O)CCC5=C3C=CC(=C5)O

InChI Key

SQQXJBRONRGLRT-XQQCSVHLSA-N

Boiling Point

699.4ºC at 760 mmHg

Melting Point

156-158ºC

Flash Point

236.5ºC

Density

1.44g/cm³

Appearance

Pale Yellow Solid

Exact Mass

472.21000

H-Bond Acceptor

H-Bond Donor

MSDS

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COA

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Spec Sheet

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