6PJ
CY5.5-PEG2
Find entries where: 6PJ
as a non-polymer is covalently linked to polymer or other heterogen groups 2 entries
Chemical Component Summary | |
|---|---|
| Name | CY5.5-PEG2 |
| Identifiers | (2~{E})-2-[(~{Z},5~{Z})-5-[1,1-dimethyl-3-[5-oxidanylidene-5-[3-[2-(2-propoxyethoxy)ethoxy]propylamino]pentyl]-6,8-disulfo-benzo[e]indol-2-ylidene]pent-3-enylidene]-3-ethyl-1,1-dimethyl-benzo[e]indole-6,8-disulfonic acid |
| Formula | C50 H65 N3 O16 S4 |
| Molecular Weight | 1,092.322 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCCOCCOCCOCCCNC(=O)CCCCN\1c2ccc3c(c2C(/C1=C/C=C\C/C=C/4\C(c5c(ccc6c5cc(cc6S(=O)(=O)O)S(=O)(=O)O)N4CC)(C)C)(C)C)cc(cc3S(=O)(=O)O)S(=O)(=O)O |
| InChI | InChI=1S/C50H65N3O16S4/c1-7-24-67-26-28-69-29-27-68-25-14-22-51-46(54)17-12-13-23-53-41-21-19-37-39(31-35(71(58,59)60)33-43(37)73(64,65)66)48(41)50(5,6)45(53)16-11-9-10-15-44-49(3,4)47-38-30-34(70(55,56)57)32-42(72(61,62)63)36(38)18-20-40(47)52(44)8-2/h9,11,15-16,18-21,30-33H,7-8,10,12-14,17,22-29H2,1-6H3,(H,51,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)/b11-9-,44-15+,45-16- |
| InChIKey | ZUDVNXAIDCSDCG-HWRGAIJTSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 138 |
| Chiral Atom Count | 0 |
| Bond Count | 143 |
| Aromatic Bond Count | 22 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 137348507 |
