(7R,8S,11S,14S)-14-Amino-11-[(2R)-3-Amino-2-Hydroxypropyl]-5,7,17-Trihydroxy-10,13-Dioxo-9,12-Diazatricyclo[14.3.1.1~2,6~]Henicosa-1(20),2(21),3,5,16,18-Hexaene-8-Carboxylic Acid

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Formula C23H28N4O8
IUPAC Name (7r,8s,11s,14s)-14-amino-11-[(2r)-3-amino-2-hydroxypropyl]-5,7,17-trihydroxy-10,13-dioxo-9,12-diazatricyclo[14.3.1.1 2,6 ]henicosa-1(20),2(21),3,5,16,18-hexaene-8-carboxylic acid
Molecular Mass 488.490 g·mol−1
Heat of Formation -1324.9 ± 16.7 kJ·mol−1
Dipole Moment 3.62 ± 1.08 D
Volume 565.39 Å 3
Surface Area 438.9 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
Synonyms
  • 9,12-diazatricyclo(14.3.1.12,6)heneicosa-1(20),2,4,6(21),16,18-hexaene-8-carboxylic acid, 14-amino-11-(3-amino-2-hydroxypropyl)-5,7,17-trihydroxy-10,13-dioxo-
  • biphenomycin a
  • ll af283alpha
  • ll-af283alpha
CAS Number(s)
  • 100296-21-7
InChIKey WLDNIJQYEWSPFC-FUCXWFLUSA-N
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