Destruxin C
[CAS# 27482-49-1]

Identification

• Name: Destruxin C
• Synonyms: 3-(3-Hydroxy-2-Methyl-Propyl)-13-Isopropyl-10,11,14-Trimethyl-16-Sec-Butyl-4-Oxa-1,8,11,14,17-Pentazabicyclo[17.3.0]Docosane-2,5,9,12,15,18-Hexone; 3-(3-Hydroxy-2-Methylpropyl)-13-Isopropyl-10,11,14-Trimethyl-16-Sec-Butyl-4-Oxa-1,8,11,14,17-Pentazabicyclo[17.3.0]Docosane-2,5,9,12,15,18-Hexone; 3-(3-Hydroxy-2-Methyl-Propyl)-13-Isopropyl-10,11,14-Trimethyl-16-Sec-Butyl-4-Oxa-1,8,11,14,17-Pentazabicyclo[17.3.0]Docosane-2,5,9,12,15,18-Triquinone
• Molecular Formula: C₃₀H₅₁N₅O₈
• Molecular Weight: 609.76
• CAS Registry Number: 27482-49-1
• SMILES: C(C1C(N2C(C(NC(C(N(C(C(N(C(C(NCCC(=O)O1)=O)C)C)=O)C(C)C)C)=O)C(CC)C)=O)CCC2)=O)C(CO)C
• InChI: 1S/C30H51N5O8/c1-9-19(5)24-29(41)34(8)25(17(2)3)30(42)33(7)20(6)26(38)31-13-12-23(37)43-22(15-18(4)16-36)28(40)35-14-10-11-21(35)27(39)32-24/h17-22,24-25,36H,9-16H2,1-8H3,(H,31,38)(H,32,39)
• InChIKey: AWWUJFLMKZWRNF-UHFFFAOYSA-N

Properties

• Density: 1.209g/cm³ (Cal.)
• Boiling point: 913.877°C at 760 mmHg (Cal.)
• Flash point: 506.495°C (Cal.)