Acarviosin

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Properties Simple | Detailed

Formula C14H25NO8
IUPAC Name (1r,2r,3s,6r)-6-[[(2r,3s,4s,5r,6s)-4,5-dihydroxy-6-methoxy-2-methyl-tetrahydropyran-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
Molecular Mass 335.350 g·mol−1
Heat of Formation -1464.4 ± 16.7 kJ·mol−1
Dipole Moment 6.18 ± 1.08 D
Volume 383.39 Å 3
Surface Area 326.71 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 0.33 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r,3s,6r)-6-[[(2r,3s,4s,5r,6s)-4,5-dihydroxy-6-methoxy-2-methyl-3-tetrahydropyranyl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
  • (1r,2r,3s,6r)-6-[[(2r,3s,4s,5r,6s)-4,5-dihydroxy-6-methoxy-2-methyl-oxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
  • (1r,2r,3s,6r)-6-[[(2r,3s,4s,5r,6s)-4,5-dihydroxy-6-methoxy-2-methyl-tetrahydropyran-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
  • (1r,2r,3s,6r)-6-[[(2r,3s,4s,5r,6s)-4,5-dihydroxy-6-methoxy-2-methyl-tetrahydropyran-3-yl]amino]-4-methylol-cyclohex-4-ene-1,2,3-triol
  • (1r,2r,3s,6r)-6-[[(2r,3s,4s,5r,6s)-4,5-dihydroxy-6-methoxy-2-methyloxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
  • (r(-))-acarviosine
  • (s(-))-acarviosine
  • acarviosine
  • alpha-d-glucopyranoside, methyl 4,6-dideoxy-4-((4,5,6-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1-yl)amino)-, (1r-(1alpha,4alpha,5beta,6alpha))-
  • methyl 4,6-dideoxy-4-(((1,4,6-5)-4,5,6-trihydroxy-3-hydroxymethyl-2-cyclohexen-1-yl)amino)glucopyranoside
CAS Number(s)
  • 141902-24-1
InChIKey KFHKERRGDZTZQJ-HHHVGSORSA-N
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