(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[5-[4-(3-methyl-6-prop-1-en-2-yl-cyclohex-2-en-1-yl)-3,5-bis(oxidanyl)phenyl]pentan-2-yloxy]oxane-3,4,5-triol

Systemtic Name: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[5-[4-(3-methyl-6-prop-1-en-2-yl-cyclohex-2-en-1-yl)-3,5-bis(oxidanyl)phenyl]pentan-2-yloxy]oxane-3,4,5-triol Openeye Name: (2R,3R,4S,5S,6R)-2-[4-[3,5-dihydroxy-4-(6-isopropenyl-3-methyl-cyclohex-2-en-1-yl)phenyl]-1-methyl-butoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: (2R,3R,4S,5S,6R)-2-[5-[3,5-dihydroxy-4-[3-methyl-6-(1-methylethenyl)-1-cyclohex-2-enyl]phenyl]pentan-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: (2R,3R,4S,5S,6R)-2-[5-[3,5-dihydroxy-4-(3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl)phenyl]pentan-2-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: (2R,3R,4S,5S,6R)-2-[4-[3,5-dihydroxy-4-(6-isopropenyl-3-methyl-cyclohex-2-en-1-yl)phenyl]-1-methyl-butoxy]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C27H40O8 MolecularWeight: 492.6017

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(CC1)C(=C)C)C2=C(C=C(C=C2O)CCCC(C)OC3C(C(C(C(O3)CO)O)O)O)O

Isomeric SMILES

CC1=CC(C(CC1)C(=C)C)C2=C(C=C(C=C2O)CCCC(C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

InChI

InChI=1S/C27H40O8/c1-14(2)18-9-8-15(3)10-19(18)23-20(29)11-17(12-21(23)30)7-5-6-16(4)34-27-26(33)25(32)24(31)22(13-28)35-27/h10-12,16,18-19,22,24-33H,1,5-9,13H2,2-4H3/t16?,18?,19?,22-,24-,25+,26-,27-/m1/s1