(2S,3S,4S,5R,6S)-6-[(E)-3-(5-ethyl-3-methoxy-4-oxidanyl-naphthalen-1-yl)-2-methyl-prop-2-enoyl]oxy-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5R,6S)-6-[(E)-3-(5-ethyl-3-methoxy-4-oxidanyl-naphthalen-1-yl)-2-methyl-prop-2-enoyl]oxy-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5R,6S)-6-[(E)-3-(5-ethyl-4-hydroxy-3-methoxy-1-naphthyl)-2-methyl-prop-2-enoyl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5R,6S)-6-[(E)-3-(5-ethyl-4-hydroxy-3-methoxy-1-naphthalenyl)-2-methyl-1-oxoprop-2-enoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5R,6S)-6-[(E)-3-(5-ethyl-4-hydroxy-3-methoxynaphthalen-1-yl)-2-methylprop-2-enoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5R,6S)-6-[(E)-3-(5-ethyl-4-hydroxy-3-methoxy-1-naphthyl)-2-methyl-acryloyl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid Formula: C23H26O10 MolecularWeight: 462.44654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1C(=C(C=C2C=C(C)C(=O)OC3C(C(C(C(O3)C(=O)O)O)O)O)OC)O

Isomeric SMILES

CCC1=CC=CC2=C1C(=C(C=C2/C=C(\C)/C(=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)OC)O

InChI

InChI=1S/C23H26O10/c1-4-11-6-5-7-13-12(9-14(31-3)16(24)15(11)13)8-10(2)22(30)33-23-19(27)17(25)18(26)20(32-23)21(28)29/h5-9,17-20,23-27H,4H2,1-3H3,(H,28,29)/b10-8+/t17-,18-,19+,20-,23-/m0/s1