GCIS
GlobalChemical Inventory Search
Octaethyl ((12,32,52,72-tetrahydroxy-2,4,6,8-tetrathia-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-15,35,55,75-tetrayl)tetrakis(methylene))tetrakis(phosphonate)
CAS Number: 610253-93-5
IUPAC name: 5,11,17,23-tetrakis(diethoxyphosphorylmethyl)-2,8,14,20-tetrathiapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-25,26,27,28-tetrol
Molecular formula: C44H60O16P4S4
Molecular weight: 1097.1
InChI: InChI=1S/C44H60O16P4S4/c1-9-53-61(49,54-10-2)25-29-17-33-41(45)34(18-29)66-36-20-31(27-63(51,57-13-5)58-14-6)22-38(43(36)47)68-40-24-32(28-64(52,59-15-7)60-16-8)23-39(44(40)48)67-37-21-30(19-35(65-33)42(37)46)26-62(50,55-11-3)56-12-4/h17-24,45-48H,9-16,25-28H2,1-8H3
InChIKey: SKACYQAKOUXTOQ-UHFFFAOYSA-N
SMILES: CCOP(=O)(CC1=CC2=C(C(=C1)SC3=CC(=CC(=C3O)SC4=CC(=CC(=C4O)SC5=C(C(=CC(=C5)CP(=O)(OCC)OCC)S2)O)CP(=O)(OCC)OCC)CP(=O)(OCC)OCC)O)OCC
EINECS: -
