Sporidesmin J
[CAS# 69799-25-3]

Identification

• Name: Sporidesmin J
• Molecular Formula: C₁₇H₁₈ClN₃O₆S₂
• Molecular Weight: 459.92
• CAS Registry Number: 69799-25-3
• SMILES: [C@@]345N([C@H]2NC1=C(OC)C(=C(C=C1[C@]2([C@H]3O)O)Cl)OC)C(=O)[C@](SS4)(C)N(C5=O)C
• InChI: 1S/C17H18ClN3O6S2/c1-15-13(23)21-12-16(25,11(22)17(21,29-28-15)14(24)20(15)2)6-5-7(18)9(26-3)10(27-4)8(6)19-12/h5,11-12,19,22,25H,1-4H3/t11-,12-,15-,16-,17-/m1/s1
• InChIKey: QMMDQXDENCYFDX-UNTBTUBKSA-N

Properties

• Density: 1.796g/cm³ (Cal.)
• Boiling point: 740.879°C at 760 mmHg (Cal.)
• Flash point: 401.869°C (Cal.)