[(2S,3R,6R)-2-[(1R)-2-[(4aS,6R,9Z,11aR)-7-oxidanylidene-3,4,4a,8,11,11a-hexahydro-2H-pyrano[3,2-b]oxonin-6-yl]-1-phenylmethoxy-ethyl]-2,6-dimethyl-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3R,6R)-2-[(1R)-2-[(4aS,6R,9Z,11aR)-7-oxidanylidene-3,4,4a,8,11,11a-hexahydro-2H-pyrano[3,2-b]oxonin-6-yl]-1-phenylmethoxy-ethyl]-2,6-dimethyl-oxan-3-yl] ethanoate Openeye Name: [(2S,3R,6R)-2-[(1R)-2-[(4aS,6R,9Z,11aR)-7-oxo-3,4,4a,8,11,11a-hexahydro-2H-pyrano[3,2-b]oxonin-6-yl]-1-benzyloxy-ethyl]-2,6-dimethyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3R,6R)-2-[(1R)-2-[(4aS,6R,9Z,11aR)-7-oxo-3,4,4a,8,11,11a-hexahydro-2H-pyrano[3,2-b]oxonin-6-yl]-1-phenylmethoxyethyl]-2,6-dimethyl-3-oxanyl] ester IUPAC Name: [(2S,3R,6R)-2-[(1R)-2-[(4aS,6R,9Z,11aR)-7-oxo-3,4,4a,8,11,11a-hexahydro-2H-pyrano[3,2-b]oxonin-6-yl]-1-phenylmethoxyethyl]-2,6-dimethyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3R,6R)-2-[(1R)-2-[(4aS,6R,9Z,11aR)-7-keto-3,4,4a,8,11,11a-hexahydro-2H-pyrano[3,2-b]oxonin-6-yl]-1-benzoxy-ethyl]-2,6-dimethyl-tetrahydropyran-3-yl] ester Formula: C29H40O7 MolecularWeight: 500.6237

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(O1)(C)C(CC2C(=O)CC=CCC3C(O2)CCCO3)OCC4=CC=CC=C4)OC(=O)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@](O1)(C)[C@@H](C[C@@H]2C(=O)C/C=C\C[C@@H]3[C@@H](O2)CCCO3)OCC4=CC=CC=C4)OC(=O)C

InChI

InChI=1S/C29H40O7/c1-20-15-16-27(34-21(2)30)29(3,36-20)28(33-19-22-10-5-4-6-11-22)18-26-23(31)12-7-8-13-24-25(35-26)14-9-17-32-24/h4-8,10-11,20,24-28H,9,12-19H2,1-3H3/b8-7-/t20-,24-,25+,26-,27-,28-,29-/m1/s1