Strictosidine

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Properties Simple | Detailed

Formula C27H34N2O9
IUPAC Name (2s,3r,4s,5s,6r)-2-[[(2s,3r,4s)-5-methoxycarbonyl-4-[[(1s)-1,2,3,4,5,6,7,8-octahydropyrido[3,4-b]indol-9-ium-4b,5,6,7,8-pentaid-1-yl]methyl]-3-vinyl-3,4-dihydro-2h-pyran-2-yl]oxy]-6-(oxidomethyl)tetrahydropyran-3,4,5-triolate
Molecular Mass 530.567 g·mol−1
Heat of Formation -1366.7 ± 16.7 kJ·mol−1
Dipole Moment 2.85 ± 1.08 D
Volume 614.27 Å 3
Surface Area 499.45 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy -0.23 ± eV
Point Group Symmetry C1
Synonyms
  • (2s-(2alpha,3beta,4beta(r*)))-3-ethenyl-2-(beta-d-glucopyranosyloxy)-3,4-dihydro-4-((2,3,4,9-tetrahydro-1h-pyrido(3,4-b)indol-1-yl) methyl)-2h-pyran-5-carboxylic acid, methyl ester
  • (4s,5r,6s)-4-[[(1s)-2,3,4,9-tetrahydro-1h-$b-carbolin-1-yl]methyl]-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-5-vinyl-5,6-dihydro-4h-pyran-3-carboxylic acid methyl ester
  • (4s,5r,6s)-4-[[(1s)-2,3,4,9-tetrahydro-1h-pyrido[3,4-b]indol-1-yl]methyl]-6-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-5-vinyl-5,6-dihydro-4h-pyran-3-carboxylic acid methyl ester
  • 2h-pyran-5-carboxylic acid, 3-ethenyl-2-(beta-d-glucopyranosyloxy)-3,4-dihydro-4-((2,3,4,9-tetrahydro-1h-pyrido(3,4-b)indol-1-yl)methyl)-, methyl ester, (2s-(2alpha,3beta,4beta(r*)))-
  • 3-alpha(s)-strictosidine
  • 3alpha(s)-strictosidine
  • isovincoside
  • methyl (2s,3r,4s)-3-ethenyl-2-(beta-d-glucopyranosyloxy)-4-[(1s)-2,3,4,9-tetrahydro-1h-pyrido[3,4-b]indol-1-ylmethyl]-3,4-dihydro-2h-pyran-5-carboxylate
  • methyl (4s,5r,6s)-4-[[(1s)-2,3,4,9-tetrahydro-1h-pyrido[3,4-b]indol-1-yl]methyl]-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-5-vinyl-5,6-dihydro-4h-pyran-3-carboxylate
  • methyl (4s,5r,6s)-5-ethenyl-4-[[(1s)-2,3,4,9-tetrahydro-1h-pyrido[3,4-b]indol-1-yl]methyl]-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6-dihydro-4h-pyran-3-carboxylate
CAS Number(s)
  • 20824-29-7
InChIKey XBAMJZTXGWPTRM-NTXHKPOFSA-N
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