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Reference substances

Reference substances

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General information

Inventory

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Reference substance information

IUPAC name:
2-[2-[1-[2-[[2-(9-oxothioxanthen-2-yl)oxyacetyl]amino]-2-[[2-(9-oxothioxanthen-2-yl)oxyacetyl]oxymethyl]-3-[1-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]propoxy]ethoxy]ethoxy]ethyl prop-2-enoate

Molecular and structural information

Molecular formula:
C52 H55 N O17 S2
Molecular weight:
>= 1 030.14
SMILES notation:
CC(OCCOCCOC(=O)C=C)OCC(COC(C)OCCOCCOC(=O)C=C)(COC(=O)COc1ccc2c(c1)c(=O)c3ccccc3s2)NC(=O)COc4ccc5c(c4)c(=O)c6ccccc6s5
InChl:
InChI=1S/C52H55NO17S2/c1-5-47(55)64-25-21-60-19-23-62-34(3)68-31-52(32-69-35(4)63-24-20-61-22-26-65-48(56)6-2,53-46(54)29-66-36-15-17-44-40(27-36)50(58)38-11-7-9-13-42(38)71-44)33-70-49(57)30-67-37-16-18-45-41(28-37)51(59)39-12-8-10-14-43(39)72-45/h5-18,27-28,34-35H,1-2,19-26,29-33H2,3-4H3,(H,53,54)
Structural formula:
Chemical structure