[(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] (2Z)-2-(1-diethoxyphosphoryloxyethylidene)-5-methyl-hex-4-enoate

Systemtic Name: [(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] (2Z)-2-(1-diethoxyphosphoryloxyethylidene)-5-methyl-hex-4-enoate Openeye Name: [(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] (2Z)-2-(1-diethoxyphosphoryloxyethylidene)-5-methyl-hex-4-enoate CAS Name: (2Z)-2-(1-diethoxyphosphoryloxyethylidene)-5-methyl-4-hexenoic acid [(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] ester IUPAC Name: [(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] (2Z)-2-(1-diethoxyphosphoryloxyethylidene)-5-methylhex-4-enoate Traditional Name: (2Z)-2-(1-diethoxyphosphoryloxyethylidene)-5-methyl-hex-4-enoic acid [(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] ester Formula: C25H41O11P MolecularWeight: 548.560201

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC(=C(CC=C(C)C)C(=O)OC1C(OC2C1OC(O2)(C)C)C3COC(O3)(C)C)C

Isomeric SMILES

CCOP(=O)(OCC)O/C(=C(/CC=C(C)C)\C(=O)O[C@H]1[C@H](O[C@H]2[C@@H]1OC(O2)(C)C)[C@H]3COC(O3)(C)C)/C

InChI

InChI=1S/C25H41O11P/c1-10-29-37(27,30-11-2)36-16(5)17(13-12-15(3)4)22(26)31-20-19(18-14-28-24(6,7)33-18)32-23-21(20)34-25(8,9)35-23/h12,18-21,23H,10-11,13-14H2,1-9H3/b17-16-/t18-,19-,20+,21-,23-/m1/s1