TDM
2-[(2E)-3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-2-(1-HYDROXYETHYLIDENE)-4-METHYL-2,3-DIHYDRO-1,3-THIAZOL-5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE
Find entries where: TDM
is present as a standalone ligand in 6 entries
Chemical Component Summary | |
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Name | 2-[(2E)-3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-2-(1-HYDROXYETHYLIDENE)-4-METHYL-2,3-DIHYDRO-1,3-THIAZOL-5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE |
Synonyms | 2-HYDROXYETHYLTHIAMIN DIPHOSPHATE |
Identifiers | 2-[(2E)-3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-2-(1-hydroxyethylidene)-4-methyl-1,3-thiazol-5-yl]ethyl phosphono hydrogen phosphate |
Formula | C14 H22 N4 O8 P2 S |
Molecular Weight | 468.359 |
Type | NON-POLYMER |
Isomeric SMILES | Cc1ncc(c(n1)N)CN\2C(=C(S/C2=C(\C)/O)CCO[P@@](=O)(O)OP(=O)(O)O)C |
InChI | InChI=1S/C14H22N4O8P2S/c1-8-12(4-5-25-28(23,24)26-27(20,21)22)29-14(9(2)19)18(8)7-11-6-16-10(3)17-13(11)15/h6,19H,4-5,7H2,1-3H3,(H,23,24)(H2,15,16,17)(H2,20,21,22)/b14-9+ |
InChIKey | ZZLCKFKIIVXBQU-NTEUORMPSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 51 |
Chiral Atom Count | 1 |
Bond Count | 52 |
Aromatic Bond Count | 6 |
Related Resource References
Resource Name | Reference |
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PubChem | 6518185 |