(2S,3S)-7-(hydroxymethyl)-6-[2-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyethyl]-2,5-dimethyl-3-oxidanyl-2,3-dihydroinden-1-one

Systemtic Name: (2S,3S)-7-(hydroxymethyl)-6-[2-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyethyl]-2,5-dimethyl-3-oxidanyl-2,3-dihydroinden-1-one Openeye Name: (2S,3S)-3-hydroxy-7-(hydroxymethyl)-2,5-dimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyethyl]indan-1-one CAS Name: (2S,3S)-3-hydroxy-7-(hydroxymethyl)-2,5-dimethyl-6-[2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]ethyl]-2,3-dihydroinden-1-one IUPAC Name: (2S,3S)-3-hydroxy-7-(hydroxymethyl)-2,5-dimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-2,3-dihydroinden-1-one Traditional Name: (2S,3S)-3-hydroxy-2,5-dimethyl-7-methylol-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxyethyl]indan-1-one Formula: C20H28O9 MolecularWeight: 412.43092

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=CC(=C(C(=C2C1=O)CO)CCOC3C(C(C(C(O3)CO)O)O)O)C)O

Isomeric SMILES

C[C@H]1[C@@H](C2=CC(=C(C(=C2C1=O)CO)CCO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C)O

InChI

InChI=1S/C20H28O9/c1-8-5-11-14(16(24)9(2)15(11)23)12(6-21)10(8)3-4-28-20-19(27)18(26)17(25)13(7-22)29-20/h5,9,13,15,17-23,25-27H,3-4,6-7H2,1-2H3/t9-,13+,15-,17+,18-,19+,20+/m0/s1