8,9,14,15-Tetrahydro-1,4,6,8,17-Pentahydroxy-20-Methoxy-18-Methyl-9,8,14-(1)Butanyl(4)Ylideneanthra(1,2-b)Benz(f)Azocine-5,16,19-Trione
[CAS# 127003-54-7]

Identification

• Name: 8,9,14,15-Tetrahydro-1,4,6,8,17-Pentahydroxy-20-Methoxy-18-Methyl-9,8,14-(1)Butanyl(4)Ylideneanthra(1,2-b)Benz(f)Azocine-5,16,19-Trione
• Synonyms: Dynemicin M
• Molecular Formula: C₂₉H₂₃NO₈
• Molecular Weight: 513.50
• CAS Registry Number: 127003-54-7
• SMILES: C2=C1C6(O)C7C(NC1=C4C(=C2O)C(=O)C3=C(O)C=CC(=C3C4=O)O)C5=CC=CC=C5C6C(OC)C(=O)C7C
• InChI: 1S/C29H23NO8/c1-10-21-23-12-6-4-3-5-11(12)22(28(38-2)25(10)34)29(21,37)13-9-16(33)19-20(24(13)30-23)27(36)18-15(32)8-7-14(31)17(18)26(19)35/h3-10,21-23,28,30-33,37H,1-2H3
• InChIKey: IIRSEVBVOPNIAG-UHFFFAOYSA-N

Properties

• Density: 1.677g/cm³ (Cal.)
• Boiling point: 816.899°C at 760 mmHg (Cal.)
• Flash point: 447.844°C (Cal.)