(1S,4R,5S)-5-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-4-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,7,7-trimethyl-bicyclo[2.2.1]heptan-3-one

Systemtic Name: (1S,4R,5S)-5-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-4-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,7,7-trimethyl-bicyclo[2.2.1]heptan-3-one Openeye Name: (1R,4S,6S)-6-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]oxymethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]oxy-1,7,7-trimethyl-norbornan-2-one CAS Name: (1S,4R,5S)-5-[[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)-2-oxolanyl]oxymethyl]-3,4,5-trihydroxy-2-oxanyl]oxy]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanone IUPAC Name: (1S,4R,5S)-5-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one Traditional Name: (1R,4S,6S)-6-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-methylol-tetrahydrofuran-2-yl]oxymethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]oxy-1,7,7-trimethyl-norbornan-2-one Formula: C21H34O11 MolecularWeight: 462.48806

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC(C1(C(=O)C2)C)OC3C(C(C(C(O3)COC4C(C(CO4)(CO)O)O)O)O)O)C

Isomeric SMILES

C[C@]12[C@H](C[C@H](C1(C)C)CC2=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO[C@H]4[C@@H]([C@](CO4)(CO)O)O)O)O)O

InChI

InChI=1S/C21H34O11/c1-19(2)9-4-11(23)20(19,3)12(5-9)32-17-15(26)14(25)13(24)10(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-10,12-18,22,24-28H,4-8H2,1-3H3/t9-,10-,12+,13-,14+,15-,16+,17+,18-,20+,21-/m1/s1