[1,2-bis(oxidanyl)-2-(5-oxidanyl-3-oxidanylidene-4-phosphonooxy-furan-2-yl)ethyl] (E)-octadec-9-enoate

Systemtic Name: [1,2-bis(oxidanyl)-2-(5-oxidanyl-3-oxidanylidene-4-phosphonooxy-furan-2-yl)ethyl] (E)-octadec-9-enoate Openeye Name: [1,2-dihydroxy-2-(5-hydroxy-3-oxo-4-phosphonooxy-2-furyl)ethyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [1,2-dihydroxy-2-(5-hydroxy-3-oxo-4-phosphonooxy-2-furanyl)ethyl] ester IUPAC Name: [1,2-dihydroxy-2-(5-hydroxy-3-oxo-4-phosphonooxyfuran-2-yl)ethyl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [1,2-dihydroxy-2-(5-hydroxy-3-keto-4-phosphonooxy-2-furyl)ethyl] ester Formula: C24H41O11P MolecularWeight: 536.549501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C(C1C(=O)C(=C(O1)O)OP(=O)(O)O)O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C(C1C(=O)C(=C(O1)O)OP(=O)(O)O)O)O

InChI

InChI=1S/C24H41O11P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(25)33-23(28)20(27)21-19(26)22(24(29)34-21)35-36(30,31)32/h9-10,20-21,23,27-29H,2-8,11-17H2,1H3,(H2,30,31,32)/b10-9+