TPP
THIAMINE DIPHOSPHATE
Find entries where: TPP
is present as a standalone ligand in 278 entries
as a non-polymer is covalently linked to polymer or other heterogen groups 8 entries
Chemical Component Summary | |
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Name | THIAMINE DIPHOSPHATE |
Identifiers | 2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate |
Formula | C12 H19 N4 O7 P2 S |
Molecular Weight | 425.314 |
Type | NON-POLYMER |
Isomeric SMILES | Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCO[P@](=O)(O)OP(=O)(O)O |
InChI | InChI=1S/C12H18N4O7P2S/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H4-,13,14,15,17,18,19,20,21)/p+1 |
InChIKey | AYEKOFBPNLCAJY-UHFFFAOYSA-O |
Chemical Details | |
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Formal Charge | 1 |
Atom Count | 45 |
Chiral Atom Count | 1 |
Bond Count | 46 |
Aromatic Bond Count | 11 |
Related Resource References
Resource Name | Reference |
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PubChem | 1132 |
ChEMBL | CHEMBL1236376 |
ChEBI | CHEBI:9532 |
CCDC/CSD | COYPOX |