(3R,5R,6R)-3-Amino-N-(3-Amino-3-Iminopropyl)-6-[[(2E,4Z)-Hexa-2,4-Dienoyl]Amino]-5-Hydroxyheptanamide
[CAS# 111337-85-0]

Identification

• Name: (3R,5R,6R)-3-Amino-N-(3-Amino-3-Iminopropyl)-6-[[(2E,4Z)-Hexa-2,4-Dienoyl]Amino]-5-Hydroxyheptanamide
• Synonyms: (3R,5R,6R)-3-Amino-N-(3-Amino-3-Imino-Propyl)-6-[[(2E,4Z)-Hexa-2,4-Dienoyl]Amino]-5-Hydroxy-Heptanamide; (3R,5R,6R)-3-Amino-N-(3-Amino-3-Iminopropyl)-5-Hydroxy-6-[[(2E,4Z)-1-Oxohexa-2,4-Dienyl]Amino]Heptanamide; (2E,4Z)-N-[(1R,2R,4R)-4-Amino-6-[(3-Amino-3-Imino-Propyl)Amino]-2-Hydroxy-6-Keto-1-Methyl-Hexyl]Hexa-2,4-Dienamide
• Molecular Formula: C₁₆H₂₉N₅O₃
• Molecular Weight: 339.44
• CAS Registry Number: 111337-85-0
• SMILES: [C@H](O)([C@H](NC(=O)\C=C\C=C/C)C)C[C@@H](N)CC(=O)NCCC(=N)N
• InChI: 1S/C16H29N5O3/c1-3-4-5-6-15(23)21-11(2)13(22)9-12(17)10-16(24)20-8-7-14(18)19/h3-6,11-13,22H,7-10,17H2,1-2H3,(H3,18,19)(H,20,24)(H,21,23)/b4-3-,6-5+/t11-,12-,13-/m1/s1
• InChIKey: HGBIYXQMCATWPJ-HPLJFFTKSA-N

Properties

• Density: 1.212g/cm³ (Cal.)