(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-Oxo-2-Butanyl]-2,4-Decadienamide

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Properties Simple | Detailed

Formula C25H40N4O6
IUPAC Name (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]deca-2,4-dienamide
Molecular Mass 492.608 g·mol−1
Heat of Formation -1110.8 ± 16.7 kJ·mol−1
Dipole Moment 4.57 ± 1.08 D
Volume 626.7 Å 3
Surface Area 526.41 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -0.31 ± eV
Point Group Symmetry C1
Synonyms
  • (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]deca-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]carbamoyl]propyl]deca-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]deca-2,4-dienamide
  • (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-oxo-butan-2-yl]deca-2,4-dienamide
  • (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]deca-2,4-dienamide
  • 2,4-decadienamide, n-(2-hydroxy-1-(((10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl)amino)carbonyl)propyl)-, (5s-(3e,5r*,8r*(1r*(2e,4e),2s*),10r*))-
  • glidobactin f
CAS Number(s)
  • 119259-72-2
InChIKey OJDBZOSAZHSDPV-UELYFCGDSA-N
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