methyl 4-({2,5'-dioxo-1,2-dihydrospiro[indole-3,3'-oxolan]-2'-yl}methyl)-3-ethenyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylate
AlkaPlorer ID: AK256597
Synonym: None
IUPAC Name: methyl (2S,3R,4S)-4-[[(2'S,3R)-2,5'-dioxospiro[1H-indole-3,3'-oxolane]-2'-yl]methyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate
Structure
SMILES: C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1OC(=O)C[C@]12C(O)=NC1=CC=CC=C12
InChI: InChI=1S/C27H31NO12/c1-3-12-13(8-18-27(9-19(30)39-18)15-6-4-5-7-16(15)28-26(27)35)14(23(34)36-2)11-37-24(12)40-25-22(33)21(32)20(31)17(10-29)38-25/h3-7,11-13,17-18,20-22,24-25,29,31-33H,1,8-10H2,2H3,(H,28,35)/t12-,13+,17-,18+,20-,21+,22-,24+,25+,27-/m1/s1
InChIKey: RTLOXEMMJLUKBN-FFHVILEJSA-N
Source
Properties Information
Molecule Weight: 561.5400000000004
TPSA？: 193.79999999999995
MolLogP？: -0.1202999999999978
Number of H-Donors: 5
Number of H-Acceptors: 12
RingCount: 5
Activities Information
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