TPP – thiamine diphosphate
| Name | ||
|---|---|---|
| WID | TPP |
|
| Name | thiamine diphosphate |
|
| Traditional name | 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-5-(2-{[(phosphonatooxy)phosphinato]oxy}ethyl)-1,3-thiazol-3-ium | |
| IUPAC name | 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-5-(2-{[(phosphonatooxy)phosphinato]oxy}ethyl)-1,3-thiazol-3-ium | |
| Cross references | PubChem: 3368, ChEBI: 9532, ThreeDMET: B01146, KNApSAcK: C00019627, KEGG: C00068, | |
| Classification | ||
| Type | vitamin |
|
| Structure | ||
| Empirical formula (pH 7.5) | H16C12N4O7P2S1 | |
| SMILES (pH 7.5) | CC1=C(CCOP([O-])(=O)OP([O-])([O-])=O)SC=[N+]1CC1=CN=C(C)N=C1N | |
| Charge (pH 7.5) | -2 | |
| Is hydrophobic | False |
|
| Molecular weight (Da) | 422.29 |
|
| van der Waals volume (pH 7.5; Å3 molecule‑1) |
320.99 | |
| ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) | -868.60 | |
| pI | 2.28 | |
| logP | -5.84 | |
| logD (pH 7.5) | -7.35 | |
| Concentrations | ||
| Biomass composition (SP4 media, 5% CO2, 37C; mmol gDCW‑1) |
|
|
| Function | ||
| Coenzyme |
|
|
| Reaction participant |
|
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| Metadata | ||
| Created | 2012-10-01 15:07:08 | |
| Last updated | 2012-10-01 15:12:34 | |
