Product Code

TRC-M304707

Product Format

Neat

Molecular Formula

C24H29D5O3

Molecular Weight

375.56

Product Categories

TRC, Bioactive small molecules, Stable isotopes, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

4811-74-9

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

3-O-Methyl 17beta-Estradiol-d5 17-O-Tetrahydropyran (Mixture of Diastereomers)

Molecular Formula

C24H29D5O3

Molecular Weight

375.56

Accurate Mass

375.28

SMILES

[H][C@]12[C@]([C@]3([2H])CC[C@@]1([C@@H](OC4CCCCO4)CC2)C)([H])C([2H])([2H])C([2H])([2H])C5=C3C=CC(OC)=C5

InChI

InChI=1S/C24H34O3/c1-24-13-12-19-18-9-7-17(25-2)15-16(18)6-8-20(19)21(24)10-11-22(24)27-23-5-3-4-14-26-23/h7,9,15,19-23H,3-6,8,10-14H2,1-2H3/t19-,20-,21+,22+,23?,24+/m1/s1/i6D2,8D2,19D

IUPAC

2-(((8R,9S,13S,14S,17S)-3-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-yl-6,6,7,7,9-d5)oxy)tetrahydro-2H-pyran

Unlabelled CAS Number

4811-74-9

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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3-O-Methyl 17Beta-Estradiol-d5 17-O-Tetrahydropyran (Mixture of Diastereomers)

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