[(2S,3R,4R,5R,6S)-2-[(3R)-5-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]-3-methyl-pent-1-en-3-yl]oxy-6-methyl-4,5-bis(oxidanyl)oxan-3-yl] ethanoate

Systemtic Name: [(2S,3R,4R,5R,6S)-2-[(3R)-5-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]-3-methyl-pent-1-en-3-yl]oxy-6-methyl-4,5-bis(oxidanyl)oxan-3-yl] ethanoate Openeye Name: [(2S,3R,4R,5R,6S)-2-[(1R)-1-[2-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]ethyl]-1-methyl-allyloxy]-4,5-dihydroxy-6-methyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3R,4R,5R,6S)-2-[(3R)-5-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-4,5-dihydroxy-6-methyl-3-oxanyl] ester IUPAC Name: [(2S,3R,4R,5R,6S)-2-[(3R)-5-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3R,4R,5R,6S)-2-[(1R)-1-[2-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]ethyl]-1-methyl-allyloxy]-4,5-dihydroxy-6-methyl-tetrahydropyran-3-yl] ester Formula: C28H46O6 MolecularWeight: 478.66124

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C(=CCCC2(C)C)C1(C)CCC(C)(C=C)OC3C(C(C(C(O3)C)O)O)OC(=O)C

Isomeric SMILES

C[C@H]1CC[C@@H]2C(=CCCC2(C)C)[C@]1(C)CC[C@](C)(C=C)O[C@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)C)O)O)OC(=O)C

InChI

InChI=1S/C28H46O6/c1-9-27(7,34-25-24(33-19(4)29)23(31)22(30)18(3)32-25)15-16-28(8)17(2)12-13-20-21(28)11-10-14-26(20,5)6/h9,11,17-18,20,22-25,30-31H,1,10,12-16H2,2-8H3/t17-,18-,20+,22-,23+,24+,25-,27-,28+/m0/s1