Allopregnan-​3b,​20a-​diol Diacetate

CAS: 6170-08-7

Ref. TR-A547138

Product Information

• Name: Allopregnan-​3b,​20a-​diol Diacetate
• Synonyms: (3β,5α,20S)-Pregnane-3,20-diol Diacetate, Allopregnane-3β,20α-diol Diacetate, (20S)-5alpha-Pregnane-3beta,20-diol diacetate, (3beta,5alpha,20S)-pregnane-3,20-diyl diacetate, 5α-Pregnane-3β,20α-diol, diacetate, Allopregnane-3β,20α-diol diacetate, Pregnane-3,20-diol, 3,20-diacetate, (3β,5α,20S)-, Pregnane-3,20-diol, diacetate, (3β,5α,20S)-
• CAS: 6170-08-7

Description

Applications Allopregnan-​3β,​20α-​diol Diacetate is a Progesterone (P755900) derivative, a steroid hormone produced by the corpus luteum. Induces maturation and secretory activity of the uterine endothelium; suppresses ovulation. Progesterone is implicated in the etiology of breast cancer.
References Anderson, E., et al.: Breast Cancer Res., 4, 197 (2002), Lanari, C., et al.: Breast Cancer Res., 4, 240 (2002), Albrecht, E.D., et al.: Front. Biosci., 8, 416 (2003), Qiu, M., et al.: J. Steroid Biochem. Mol. Biol., 85, 147 (2003),

• Brand: TRC

Chemical properties

• Molecular weight: 404.58
• Formula: C₂₅H₄₀O₄
• Color/Form: White to Off-White Solid
• InChI: InChI=1S/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18-,19-,20-,21+,22-,23-,24-,25+/m0/s1
• InChI key: InChIKey=VDZDKQBSTYNFGG-CVDNUPSHSA-N
• SMILES: CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)OC(C)=O)CC[C@@H]32)C1