3,3a,11,12-Tetrahydro-9,13-Dihydroxy-3a-Methoxy-11-Methyl-5a-((Tetrahydro-5-Hydroxy-6-2H-Pyran-2-Yl)Oxy)-2H,5H-Furo(2'',3'':3',5')Furo(3',4':6,7)Naphth(2,3-e)Isoindole-2,6,10,14(5aH)-Tetrone
[CAS# 182234-02-2]

Identification

• Name: 3,3a,11,12-Tetrahydro-9,13-Dihydroxy-3a-Methoxy-11-Methyl-5a-((Tetrahydro-5-Hydroxy-6-2H-Pyran-2-Yl)Oxy)-2H,5H-Furo(2'',3'':3',5')Furo(3',4':6,7)Naphth(2,3-e)Isoindole-2,6,10,14(5aH)-Tetrone
• Synonyms: Lactonamycin
• Molecular Formula: C₂₈H₂₇NO₁₂
• Molecular Weight: 569.52
• CAS Registry Number: 182234-02-2
• SMILES: [C@]34(O[C@@H]1O[C@H]([C@@H](O)CC1)C)C2(OC(=O)C[C@@]2(OC3)OC)C(=O)C5=C(C4=O)C=C6C(=C5O)C7=C(C(=C6)O)C(=O)N(C7)C
• InChI: 1S/C28H27NO12/c1-11-15(30)4-5-18(39-11)41-26-10-38-27(37-3)8-17(32)40-28(26,27)24(35)21-13(23(26)34)6-12-7-16(31)20-14(19(12)22(21)33)9-29(2)25(20)36/h6-7,11,15,18,30-31,33H,4-5,8-10H2,1-3H3/t11-,15-,18-,26+,27-,28?/m0/s1
• InChIKey: XFQJOLWXLJXJSV-JESNWKQSSA-N

Properties

• Density: 1.68g/cm³ (Cal.)
• Boiling point: 943.013°C at 760 mmHg (Cal.)
• Flash point: 524.116°C (Cal.)