(3S,3As,5R,9R,9Ar)-5-Hydroxy-7'-Methoxy-5'-Methyl-2,2'-Dioxo-5-[(4R)-2-Oxo-1,3-Dioxolan-4-Yl]-3A,5,9,9A-Tetrahydro-2'H-Spiro[S-Indaceno[2,1-B]Furan-3,1'-Naphthalen]-9-Yl 2,6-Dideoxy-2-(Methylammonio)-α-D-Galactopyranoside

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Properties Simple | Detailed

Formula C35H36NO12+
IUPAC Name (3s,3as,5r,9r,9ar)-5-hydroxy-7'-methoxy-5'-methyl-2,2'-dioxo-5-[(4r)-2-oxo-1,3-dioxolan-4-yl]-3a,5,9,9a-tetrahydro-2'h-spiro[s-indaceno[2,1-b]furan-3,1'-naphthalen]-9-yl 2,6-dideoxy-2-(methylammonio)- α-d-galactopyranoside
Molecular Mass 662.660 g·mol−1
Heat of Formation -1590.0 ± 16.7 kJ·mol−1
Dipole Moment 24.02 ± 1.08 D
Volume 737.33 Å 3
Surface Area 524.6 Å 2
Point Group Symmetry C1
Synonyms
  • ncs
  • spiro[[7-methoxy-5-methyl-1,2-dihydro-naphthalene]-3,1'-[5-hydroxy-9-[2-methylamino-2,6-dideoxygalactopyranosyl-oxy]-5-(2-oxo-[1,3]dioxolan-4-yl)-3a,5,9,9a-tetrahydro-3h-1-oxa-cyclopenta[a]-s-indacen-2-one]]
InChIKey OBDNPHCYNBAIOJ-KDIFMUJMSA-O
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