Astromicin B

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Properties Simple | Detailed

Formula C15H32N4O5
IUPAC Name (1s,2s,3r,4r,5s,6r)-2-amino-3-[(2r,3r,6s)-3-amino-6-[(1s)-1-aminoethyl]tetrahydropyran-2-yl]oxy-6-methoxy-5-(methylamino)cyclohexane-1,4-diol
Molecular Mass 348.438 g·mol−1
Heat of Formation -988.9 ± 16.7 kJ·mol−1
Dipole Moment 4.31 ± 1.08 D
Volume 431.52 Å 3
Surface Area 342.38 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy 1.41 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2s,3s,4r,5s,6r)-2-amino-3,6-dihydroxy-5-(methylamino)-4-(methyloxy)cyclohexyl 2,6-diamino-2,3,4,6,7-pentadeoxy-beta-l-lyxo-heptopyranoside
  • (1s,2s,3r,4r,5s,6r)-2-amino-3-[(2r,3r,6s)-3-amino-6-[(1s)-1-aminoethyl]oxan-2-yl]oxy-6-methoxy-5-methylamino-cyclohexane-1,4-diol
  • (1s,2s,3r,4r,5s,6r)-2-amino-3-[(2r,3r,6s)-3-amino-6-[(1s)-1-aminoethyl]oxan-2-yl]oxy-6-methoxy-5-methylaminocyclohexane-1,4-diol
  • (1s,2s,3r,4r,5s,6r)-2-amino-3-[(2r,3r,6s)-3-amino-6-[(1s)-1-aminoethyl]tetrahydropyran-2-yl]oxy-6-methoxy-5-methylamino-cyclohexane-1,4-diol
  • (1s,2s,3r,4r,5s,6r)-2-amino-3-[[(2r,3r,6s)-3-amino-6-[(1s)-1-aminoethyl]-2-tetrahydropyranyl]oxy]-6-methoxy-5-methylaminocyclohexane-1,4-diol
InChIKey WFMQYKIRAVMXSU-LCVFDZPESA-N
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