(2R,3R,4S,5S,6R)-2-[[(2R,3R,4aR,6R,8aS)-6-[2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxypropan-2-yl]-8a-methyl-4-methylidene-3-oxidanyl-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Systemtic Name: (2R,3R,4S,5S,6R)-2-[[(2R,3R,4aR,6R,8aS)-6-[2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxypropan-2-yl]-8a-methyl-4-methylidene-3-oxidanyl-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: (2R,3R,4S,5S,6R)-2-[(2R,3R,4aR,6R,8aS)-3-hydroxy-8a-methyl-4-methylene-6-[1-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-ethyl]decalin-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: (2R,3R,4S,5S,6R)-2-[[(2R,3R,4aR,6R,8aS)-3-hydroxy-8a-methyl-4-methylene-6-[2-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]propan-2-yl]-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: (2R,3R,4S,5S,6R)-2-[[(2R,3R,4aR,6R,8aS)-3-hydroxy-8a-methyl-4-methylidene-6-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-1,2,3,4a,5,6,7,8-octahydronaphthalen-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: (2R,3R,4S,5S,6R)-2-[(2R,3R,4aR,6R,8aS)-3-hydroxy-8a-methyl-4-methylene-6-[1-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-ethyl]decalin-2-yl]oxy-6-methylol-tetrahydropyran-3,4,5-triol Formula: C27H46O13 MolecularWeight: 578.64634

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(CC1C(=C)C(C(C2)OC3C(C(C(C(O3)CO)O)O)O)O)C(C)(C)OC4C(C(C(C(O4)CO)O)O)O

Isomeric SMILES

C[C@@]12CC[C@H](C[C@H]1C(=C)[C@H]([C@@H](C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)C(C)(C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

InChI

InChI=1S/C27H46O13/c1-11-13-7-12(26(2,3)40-25-23(36)21(34)19(32)16(10-29)39-25)5-6-27(13,4)8-14(17(11)30)37-24-22(35)20(33)18(31)15(9-28)38-24/h12-25,28-36H,1,5-10H2,2-4H3/t12-,13+,14-,15-,16-,17-,18-,19-,20+,21+,22-,23-,24-,25+,27+/m1/s1