3',4'-Dihydroxyetoposide
[CAS# 100007-54-3]

Identification

• Name: 3',4'-Dihydroxyetoposide
• Synonyms: (5R,5Ar,8Ar,9S)-9-[[(2R,4Ar,6R,7R,8R,8As)-7,8-Dihydroxy-2-Methyl-4,4A,6,7,8,8A-Hexahydropyrano[5,6-D][1,3]Dioxin-6-Yl]Oxy]-5-(3,4-Dihydroxy-5-Methoxyphenyl)-5A,8,8A,9-Tetrahydro-5H-Isobenzofurano[6,5-F][1,3]Benzodioxol-6-One; Dhvp-16-213; Furo(3',4':6,7)Naphtho(2,3-D)-1,3-Dioxol-6(5Ah)-One, 5-(3,4-Dihydroxy-5-Methoxyphenyl)-9-((4,6-O-Ethylidene-Beta-D-Glucopyranosyl)Oxy)-5,8,8A,9-Tetrahydro-, (5R-(5Alpha,5Abeta,8Aalpha,9Beta(R*)))-
• Molecular Formula: C₂₈H₃₀O₁₃
• Molecular Weight: 574.54
• CAS Registry Number: 100007-54-3
• SMILES: [C@H]37[C@@H]([C@H](O[C@@H]2O[C@H]1[C@@H](O[C@@H](OC1)C)[C@H](O)[C@H]2O)C6=C([C@H]3C4=CC(=C(O)C(=C4)OC)O)C=C5OCOC5=C6)COC7=O
• InChI: 1S/C28H30O13/c1-10-35-8-19-26(39-10)23(31)24(32)28(40-19)41-25-13-6-17-16(37-9-38-17)5-12(13)20(21-14(25)7-36-27(21)33)11-3-15(29)22(30)18(4-11)34-2/h3-6,10,14,19-21,23-26,28-32H,7-9H2,1-2H3/t10-,14+,19-,20-,21+,23-,24-,25-,26-,28+/m1/s1
• InChIKey: CYOJPLOJEPTJMM-FMEAWWTOSA-N

Properties

• Density: 1.624g/cm³ (Cal.)
• Boiling point: 824.343°C at 760 mmHg (Cal.)
• Flash point: 275.513°C (Cal.)