(16-diethoxyphosphoryloxy-4,6,11,13-tetramethoxy-hexahelicen-1-yl) diethyl phosphate

Systemtic Name: (16-diethoxyphosphoryloxy-4,6,11,13-tetramethoxy-hexahelicen-1-yl) diethyl phosphate Openeye Name: (16-diethoxyphosphoryloxy-4,6,11,13-tetramethoxy-hexahelicen-1-yl) diethyl phosphate CAS Name: phosphoric acid (16-diethoxyphosphoryloxy-4,6,11,13-tetramethoxy-1-hexahelicenyl) diethyl ester IUPAC Name: (16-diethoxyphosphoryloxy-4,6,11,13-tetramethoxyhexahelicen-1-yl) diethyl phosphate Traditional Name: phosphoric acid (16-diethoxyphosphoryloxy-4,6,11,13-tetramethoxy-hexahelicen-1-yl) diethyl ester Formula: C38H42O12P2 MolecularWeight: 752.680402

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1=C2C(=C(C=C1)OC)C=C(C3=C2C4=C(C=C3)C=CC5=C4C6=C(C=CC(=C6C=C5OC)OC)OP(=O)(OCC)OCC)OC

Isomeric SMILES

CCOP(=O)(OCC)OC1=C2C(=C(C=C1)OC)C=C(C3=C2C4=C(C=C3)C=CC5=C4C6=C(C=CC(=C6C=C5OC)OC)OP(=O)(OCC)OCC)OC

InChI

InChI=1S/C38H42O12P2/c1-9-45-51(39,46-10-2)49-30-19-17-28(41-5)26-21-32(43-7)24-15-13-23-14-16-25-33(44-8)22-27-29(42-6)18-20-31(50-52(40,47-11-3)48-12-4)36(27)38(25)34(23)37(24)35(26)30/h13-22H,9-12H2,1-8H3