Nodakenin

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Properties Simple | Detailed

Formula C20H24O9
IUPAC Name (2r)-2-[1-methyl-1-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-ethyl]-2,3-dihydrofuro[3,2-g]chromen-7-one
Molecular Mass 408.399 g·mol−1
Heat of Formation -1437.7 ± 16.7 kJ·mol−1
Dipole Moment 9.92 ± 1.08 D
Volume 462.75 Å 3
Surface Area 389.1 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • (+)-marmesinin
  • (2r)-2-[1-methyl-1-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-ethyl]-2,3-dihydrofuro[3,2-g]chromen-7-one
  • (2r)-2-[1-methyl-1-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-ethyl]-2,3-dihydrofuro[3,2-g]chromen-7-one
  • (2r)-2-[1-methyl-1-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]ethyl]-2,3-dihydrofuro[3,2-g]chromen-7-one
  • (2r)-2-[2-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-7-one
  • 7h-furo(3,2-g)(1)benzopyran-7-one, 2-(1-(beta-d-glucopyranosyloxy)-1-methylethyl)-2,3-dihydro-, (2r)-
  • 7h-furo[3,2-g][1]benzopyran-7-one, 2-[1-(.beta.-d-glucopyranosyloxy)-1- methylethyl]-2,3-dihydro-, (2r)
  • megxp0_001251
  • nodakenetin, b-d-glucopyranoside
  • nodakenetin, beta-d-glucopyranoside
CAS Number(s)
  • 495-31-8
InChIKey HXCGUCZXPFBNRD-DNLMCPORSA-N
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