(2,3-dibutoxy-1,2,3,6-tetrabutyl-4-oxidanyl-5,6-diphosphonooxy-cyclohexyl) dihydrogen phosphate

Systemtic Name: (2,3-dibutoxy-1,2,3,6-tetrabutyl-4-oxidanyl-5,6-diphosphonooxy-cyclohexyl) dihydrogen phosphate Openeye Name: (2,3-dibutoxy-1,2,3,6-tetrabutyl-4-hydroxy-5,6-diphosphonooxy-cyclohexyl) dihydrogen phosphate CAS Name: (2,3-dibutoxy-1,2,3,6-tetrabutyl-4-hydroxy-5,6-diphosphonooxycyclohexyl) dihydrogen phosphate IUPAC Name: (2,3-dibutoxy-1,2,3,6-tetrabutyl-4-hydroxy-5,6-diphosphonooxycyclohexyl) dihydrogen phosphate Traditional Name: (2,3-dibutoxy-1,2,3,6-tetrabutyl-4-hydroxy-5,6-diphosphonooxy-cyclohexyl) dihydrogen phosphate Formula: C30H63O15P3 MolecularWeight: 756.733503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(C(C(C(C1(CCCC)OCCCC)(CCCC)OP(=O)(O)O)(CCCC)OP(=O)(O)O)OP(=O)(O)O)O)OCCCC

Isomeric SMILES

CCCCC1(C(C(C(C(C1(CCCC)OCCCC)(CCCC)OP(=O)(O)O)(CCCC)OP(=O)(O)O)OP(=O)(O)O)O)OCCCC

InChI

InChI=1S/C30H63O15P3/c1-7-13-19-27(41-23-17-11-5)25(31)26(43-46(32,33)34)28(20-14-8-2,44-47(35,36)37)30(22-16-10-4,45-48(38,39)40)29(27,21-15-9-3)42-24-18-12-6/h25-26,31H,7-24H2,1-6H3,(H2,32,33,34)(H2,35,36,37)(H2,38,39,40)