Verticillin
[CAS# 12795-76-5]

Identification

• Name: Verticillin
• Synonyms: Verticillins
• Molecular Formula: C₃₀H₂₈N₆O₄S₄
• Molecular Weight: 664.83
• CAS Registry Number: 12795-76-5
• SMILES: [C@@]12%10C(N(C)[C@@](C(N1[C@@H]3[C@](C2)(C4=C(N3)C=CC=C4)[C@]78C[C@]56SS[C@](C)(N(C)C5=O)C(=O)N6[C@H]7NC9=C8C=CC=C9)=O)(C)SS%10)=O
• InChI: 1S/C30H28N6O4S4/c1-25-21(37)35-19-27(15-9-5-7-11-17(15)31-19,13-29(35,43-41-25)23(39)33(25)3)28-14-30-24(40)34(4)26(2,42-44-30)22(38)36(30)20(28)32-18-12-8-6-10-16(18)28/h5-12,19-20,31-32H,13-14H2,1-4H3/t19-,20-,25+,26+,27+,28+,29+,30+/m1/s1
• InChIKey: PVVLIIZIQXDFSP-PNVYSBBASA-N

Properties

• Desity: 1.762g/cm³ (Cal.)