5-Pregnen-3,20-Diol Glucoside
[CAS# 99207-79-1]

Identification

• Name: 5-Pregnen-3,20-Diol Glucoside
• Synonyms: 2-[1-(3-Hydroxy-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Ethoxy]-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol; 2-[1-(3-Hydroxy-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenan
• Molecular Formula: C₂₇H₄₄O₇
• Molecular Weight: 480.64
• CAS Registry Number: 99207-79-1
• SMILES: C(O)C5OC(OC(C4C3(C(C1C(C2(C(=CC1)CC(O)CC2)C)CC3)CC4)C)C)C(O)C(O)C5O
• InChI: 1S/C27H44O7/c1-14(33-25-24(32)23(31)22(30)21(13-28)34-25)18-6-7-19-17-5-4-15-12-16(29)8-10-26(15,2)20(17)9-11-27(18,19)3/h4,14,16-25,28-32H,5-13H2,1-3H3
• InChIKey: ZSJWDKSRQKSIBU-UHFFFAOYSA-N

Properties

• Density: 1.278g/cm³ (Cal.)
• Boiling point: 647.12°C at 760 mmHg (Cal.)
• Flash point: 345.166°C (Cal.)