Pradimicin L
[CAS# 142062-87-1]

Identification

• Name: Pradimicin L
• Synonyms: D-Alanine, N-((5-((4,6-Dideoxy-3-O-Beta-D-Glucopyranosyl-4-(Methylamino)-Beta-D-Galactopyranosyl)Oxy)-5,6,8,13-Tetrahydro-1,6,9,14-Tetrahydroxy-11-Methoxy-3-Methyl-8,13-Dioxobenzo(A)Naphthacen-2-Yl)Carbonyl)-, (5S-Trans)-; N-((5-O-(4,6-Dideoxy-4-(Methylamino)-3-O-(Beta-D-Glucopyranosyl)-Beta-D-Galactopyranosyl)-5,6,8,13-Tetrahydro-1,5,6,9,14-Pentahydroxy-11-Methoxy-3-Methyl-8,13-Dioxobenzo(A)Naphthacene-2-Yl)Carbonyl)-D-Alanine; Pradimicin L
• Molecular Formula: C₄₂H₄₈N₂O₁₉
• Molecular Weight: 884.84
• CAS Registry Number: 142062-87-1
• SMILES: [C@H]4(O[C@H]2O[C@H]([C@@H](NC)[C@@H](O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)[C@@H]2O)C)C7=C(C3=C(O)C5=C(C=C3[C@@H]4O)C(=O)C6=C(C5=O)C=C(OC)C=C6O)C(=C(C(=C7)C)C(=O)N[C@@H](C(OC)=O)C)O
• InChI: 1S/C42H48N2O19/c1-12-7-19-25(32(51)22(12)39(56)44-13(2)40(57)59-6)24-17(10-18-26(33(24)52)29(48)16-8-15(58-5)9-20(46)23(16)28(18)47)30(49)37(19)62-42-36(55)38(27(43-4)14(3)60-42)63-41-35(54)34(53)31(50)21(11-45)61-41/h7-10,13-14,21,27,30-31,34-38,41-43,45-46,49-55H,11H2,1-6H3,(H,44,56)/t13-,14+,21-,27-,30+,31-,34+,35-,36+,37+,38-,41+,42-/m1/s1
• InChIKey: XBOFKRSRRQVHGD-JBBRCQKFSA-N

Properties

• Density: 1.649g/cm³ (Cal.)
• Boiling point: 1113.844°C at 760 mmHg (Cal.)
• Flash point: 627.43°C (Cal.)