2-[5-methyl-6-[(10E,14E)-4,6,12,14,16-pentamethyl-3,5,7,13-tetrakis(oxidanyl)nonadeca-10,14,18-trien-2-yl]oxan-2-yl]propanoic acid

Systemtic Name: 2-[5-methyl-6-[(10E,14E)-4,6,12,14,16-pentamethyl-3,5,7,13-tetrakis(oxidanyl)nonadeca-10,14,18-trien-2-yl]oxan-2-yl]propanoic acid Openeye Name: 2-[5-methyl-6-[(9E,13E)-2,4,6,12-tetrahydroxy-1,3,5,11,13,15-hexamethyl-octadeca-9,13,17-trienyl]tetrahydropyran-2-yl]propanoic acid CAS Name: 2-[5-methyl-6-[(10E,14E)-3,5,7,13-tetrahydroxy-4,6,12,14,16-pentamethylnonadeca-10,14,18-trien-2-yl]-2-oxanyl]propanoic acid IUPAC Name: 2-[5-methyl-6-[(10E,14E)-3,5,7,13-tetrahydroxy-4,6,12,14,16-pentamethylnonadeca-10,14,18-trien-2-yl]oxan-2-yl]propanoic acid Traditional Name: 2-[5-methyl-6-[(9E,13E)-2,4,6,12-tetrahydroxy-1,3,5,11,13,15-hexamethyl-octadeca-9,13,17-trienyl]tetrahydropyran-2-yl]propionic acid Formula: C33H58O7 MolecularWeight: 566.80942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(OC1C(C)C(C(C)C(C(C)C(CCC=CC(C)C(C(=CC(C)CC=C)C)O)O)O)O)C(C)C(=O)O

Isomeric SMILES

CC1CCC(OC1C(C)C(C(C)C(C(C)C(CC/C=C/C(C)C(/C(=C/C(C)CC=C)/C)O)O)O)O)C(C)C(=O)O

InChI

InChI=1S/C33H58O7/c1-10-13-19(2)18-22(5)29(35)20(3)14-11-12-15-27(34)23(6)30(36)25(8)31(37)26(9)32-21(4)16-17-28(40-32)24(7)33(38)39/h10-11,14,18-21,23-32,34-37H,1,12-13,15-17H2,2-9H3,(H,38,39)/b14-11+,22-18+