Methyl (3alpha,5beta)-17-oxoandrostan-3-yl 2,3,4-tri-O-acetyl-beta-D-glucopyranosiduronate | CAS No. 21238-41-5

Methyl (3alpha,5beta)-17-oxoandrostan-3-yl 2,3,4-tri-O-acetyl-beta-D-glucopyranosiduronate

Basic Information

CAS Number

21238-41-5

Molecular Formula

C32H46O11

Molecular Weight

606.71 g/mol

AD

Basic Physical Properties

COC(=O)[C@H]1O[C@@H](O[C@@H]2CC[C@]3(C)[C@H]4CC[C@@]5(C)[C@@H](CCC5=O)[C@@H]4CC[C@@H]3C2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

InChI

InChI=1S/C32H46O11/c1-16(33)39-25-26(40-17(2)34)28(41-18(3)35)30(43-27(25)29(37)38-6)42-20-11-13-31(4)19(15-20)7-8-21-22-9-10-24(36)32(22,5)14-12-23(21)31/h19-23,25-28,30H,7-15H2,1-6H3/t19-,20-,21+,22+,23+,25+,26+,27+,28-,30-,31+,32+/m1/s1

InChIKey

AMYSMHDMEUWMDZ-SDTPIHHSSA-N

LogP

3.676400000000002

Topological Polar Surface Area

140.73000000000002 Ų

Hydrogen Bond Donor/Acceptor

0 / 11

Synonyms & References

English

  • 5β-Androsterone β-D-Glucuronide Triacetate Methyl Ester

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