(3'S,3As,4'S,5S,6'S,11Bs)-3'-{[(2R,5S,6R)-5-(Dimethylamino)-6-Methyltetrahydro-2H-Pyran-2-Yl]Oxy}-7-Hydroxy-6'-Methyl-2,6,11-Trioxo-2,3,3',3A,4',5',6,6',11,11B-Decahydrospiro[Benzo[G]Furo[3,2-C]Isochromene-5,2'-Pyran]-4'-Yl Acetate

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Properties Simple | Detailed

Formula C30H35NO11
IUPAC Name [(3's,4's,6's,11s,15s,17s)-3'-[(2r,5s,6r)-5-(dimethylamino)-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6'-methyl-2,9,13-trioxo-spiro[12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6-tetraene-17,2'-tetrahydropyran]-4'-yl] acetate
Molecular Mass 585.599 g·mol−1
Heat of Formation -1821.3 ± 16.7 kJ·mol−1
Dipole Moment 1.22 ± 1.08 D
Volume 656.9 Å 3
Surface Area 466.76 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 1.15 ± eV
Point Group Symmetry C1
Synonyms
  • 3'-o-alpha-d-forosaminyl-(+)-griseusin a
  • spiro(5h-furo(3.2-b)naphtho(2,3-d)pyran-5,2'-(2h)pyran-2,6,11(3h)-trione, 4'-(acetyloxy)-3'-((5-(dimethylamino)tetrahydro-6-methyl-2h-pyran-2-yl)oxy)-3',3a,4',5',6',11b-hexahydro-7-hydroxy-6'-methyl-, (2'r-(2'-alpha(3ar*,11br*),3'-alpha(2r*,5s*,6r*),4'-alpha,6'-beta))-
CAS Number(s)
  • 158268-23-6
InChIKey GBCIKOFDQWOMIP-YVYZCLHYSA-N
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