3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-3-[11-[1-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-3-oxidanyl-3-oxidanylidene-propyl]-3,9-bis(2-methyl-1-oxidanyl-propan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-11-yl]propanoic acid

Systemtic Name: 3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-3-[11-[1-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-3-oxidanyl-3-oxidanylidene-propyl]-3,9-bis(2-methyl-1-oxidanyl-propan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-11-yl]propanoic acid Openeye Name: 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)-3-[11-[1-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)-3-hydroxy-3-oxo-propyl]-3,9-bis(2-hydroxy-1,1-dimethyl-ethyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-11-yl]propanoic acid CAS Name: 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)-3-[11-[1-(3-tert-butyl-4-hydroxy-5-methylphenyl)-3-hydroxy-3-oxopropyl]-3,9-bis(1-hydroxy-2-methylpropan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-11-yl]propanoic acid IUPAC Name: 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)-3-[11-[1-(3-tert-butyl-4-hydroxy-5-methylphenyl)-3-hydroxy-3-oxopropyl]-3,9-bis(1-hydroxy-2-methylpropan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-11-yl]propanoic acid Traditional Name: 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)-3-[11-[1-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)-3-hydroxy-3-keto-propyl]-3,9-bis(2-hydroxy-1,1-dimethyl-ethyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-11-yl]propionic acid Formula: C43H64O12 MolecularWeight: 772.96106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(CC(=O)O)C2(C3(COC(OC3)C(C)(C)CO)COC(O2)C(C)(C)CO)C(CC(=O)O)C4=CC(=C(C(=C4)C(C)(C)C)O)C)C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C(CC(=O)O)C2(C3(COC(OC3)C(C)(C)CO)COC(O2)C(C)(C)CO)C(CC(=O)O)C4=CC(=C(C(=C4)C(C)(C)C)O)C)C(C)(C)C)O

InChI

InChI=1S/C43H64O12/c1-24-13-26(15-30(34(24)50)38(3,4)5)28(17-32(46)47)43(29(18-33(48)49)27-14-25(2)35(51)31(16-27)39(6,7)8)42(23-54-37(55-43)41(11,12)20-45)21-52-36(53-22-42)40(9,10)19-44/h13-16,28-29,36-37,44-45,50-51H,17-23H2,1-12H3,(H,46,47)(H,48,49)