[2R,(+)]-4alpha-(Dimethylamino)-3,4,5,6,11,12,13,14-Octahydro-3beta,5beta,8,10,13alpha-Pentahydroxy-6,13-Dimethyl-11alpha-Propoxy-2alpha,6alpha-Epoxy-2H-Naphthaceno[1,2-b]Oxocin-9,16-Dione
[CAS# 71628-98-3]

Identification

• Name: [2R,(+)]-4alpha-(Dimethylamino)-3,4,5,6,11,12,13,14-Octahydro-3beta,5beta,8,10,13alpha-Pentahydroxy-6,13-Dimethyl-11alpha-Propoxy-2alpha,6alpha-Epoxy-2H-Naphthaceno[1,2-b]Oxocin-9,16-Dione
• Molecular Formula: C₃₀H₃₅NO₁₀
• Molecular Weight: 569.61
• CAS Registry Number: 71628-98-3
• SMILES: [C@]16(O[C@@H](OC2=C3C(=C(O)C=C12)C(=O)C4=C(C3=O)C=C5C(=C4O)[C@@H](OCCC)CC(O)(C5)C)[C@H](O)[C@H](N(C)C)[C@@H]6O)C
• InChI: 1S/C30H35NO10/c1-6-7-39-16-11-29(2,38)10-12-8-13-18(23(34)17(12)16)24(35)19-15(32)9-14-26(20(19)22(13)33)40-28-25(36)21(31(4)5)27(37)30(14,3)41-28/h8-9,16,21,25,27-28,32,34,36-38H,6-7,10-11H2,1-5H3/t16-,21-,25+,27-,28+,29?,30+/m0/s1
• InChIKey: PPMMOHFEQJMJHI-FZYHJQPSSA-N

Properties

• Density: 1.531g/cm³ (Cal.)
• Boiling point: 807.525°C at 760 mmHg (Cal.)
• Flash point: 442.176°C (Cal.)