(2E,4E)-N-[(2S,3R)-3-Hydroxy-1-[[(3Z,5S,8S,10S)-10-Hydroxy-5-Methyl-2,7-Dioxo-1,6-Diazacyclododec-3-En-8-Yl]Amino]-1-Oxobutan-2-Yl]-11-Methyldodeca-2,4-Dienamide
[CAS# 130743-08-7]

Identification

• Name: (2E,4E)-N-[(2S,3R)-3-Hydroxy-1-[[(3Z,5S,8S,10S)-10-Hydroxy-5-Methyl-2,7-Dioxo-1,6-Diazacyclododec-3-En-8-Yl]Amino]-1-Oxobutan-2-Yl]-11-Methyldodeca-2,4-Dienamide
• Synonyms: (2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[(3Z,5S,8S,10S)-10-Hydroxy-5-Methyl-2,7-Dioxo-1,6-Diazacyclododec-3-En-8-Yl]Carbamoyl]Propyl]-11-Methyl-Dodeca-2,4-Dienamide; (2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3Z,5S,8S,10S)-10-Hydroxy-5-Methyl-2,7-Dioxo-1,6-Diazacyclododec-3-En-8-Yl]Amino]-Oxomethyl]Propyl]-11-Methyldodeca-2,4-Dienamide; (2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[(3Z,5S,8S,10S)-10-Hydroxy-2,7-Diketo-5-Methyl-1,6-Diazacyclododec-3-En-8-Yl]Carbamoyl]Propyl]-11-Methyl-Dodeca-2,4-Dienamide
• Molecular Formula: C₂₈H₄₆N₄O₆
• Molecular Weight: 534.69
• CAS Registry Number: 130743-08-7
• SMILES: [C@@H]1(NC(=O)[C@@H](NC(=O)\C=C\C=C\CCCCCC(C)C)[C@H](O)C)C(=O)N[C@H](\C=C/C(=O)NCC[C@H](O)C1)C
• InChI: 1S/C28H46N4O6/c1-19(2)12-10-8-6-5-7-9-11-13-25(36)32-26(21(4)33)28(38)31-23-18-22(34)16-17-29-24(35)15-14-20(3)30-27(23)37/h7,9,11,13-15,19-23,26,33-34H,5-6,8,10,12,16-18H2,1-4H3,(H,29,35)(H,30,37)(H,31,38)(H,32,36)/b9-7+,13-11+,15-14-/t20-,21+,22-,23-,26-/m0/s1
• InChIKey: SVHNVAFCZJDSIW-VBFMYEFXSA-N

Properties

• Density: 1.154g/cm³ (Cal.)
• Boiling point: 890.175°C at 760 mmHg (Cal.)
• Flash point: 492.16°C (Cal.)