(2E,4E)-N-[(2R,4R)-4-Amino-6-{[(3Z)-3-Amino-3-Iminopropyl]Amino}-2-Hydroxy-6-Oxohexyl]-2,4-Hexadienamide

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Properties Simple | Detailed

Formula C15H27N5O3
IUPAC Name (3r,5r)-3-amino-n-(3-amino-3-imino-propyl)-6-[[(2e,4e)-hexa-2,4-dienoyl]amino]-5-hydroxy-hexanamide
Molecular Mass 325.407 g·mol−1
Heat of Formation -509.0 ± 16.7 kJ·mol−1
Dipole Moment 6.49 ± 1.08 D
Volume 421.2 Å 3
Surface Area 350.57 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e)-n-[(2r,4r)-4-amino-6-[(3-amino-3-imino-propyl)amino]-2-hydroxy-6-keto-hexyl]hexa-2,4-dienamide
  • (2e,4e)-n-[(2r,4r)-4-amino-6-[(3-amino-3-imino-propyl)amino]-2-hydroxy-6-oxo-hexyl]hexa-2,4-dienamide
  • (2e,4e)-n-[(2r,4r)-4-amino-6-[(3-amino-3-iminopropyl)amino]-2-hydroxy-6-oxohexyl]hexa-2,4-dienamide
  • l-threo-hexonamide, 3-amino-n-(3-amino-3-iminopropyl)-2,3,4,6-tetradeoxy-6-((1-oxo-2,4-hexadienyl)amino)-, (e,e)-
  • sperabillin c
CAS Number(s)
  • 111337-84-9
InChIKey OAXPQNCOMDEHMJ-IFCBYPGCSA-N
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