Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D09HSI
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| Former ID |
DNC003158
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| Drug Name |
4'-Phosphopantetheine
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| Synonyms |
4'-phosphopantetheine; Phosphopantetheine; Psh-4'-P; Pantetheine-4'-phosphate; D-Pantetheine 4'-phosphate; UNII-NM39WU8OFM; 2226-71-3; NM39WU8OFM; O(4)-phosphono-D-pantethein; (2R)-2-Hydroxy-N-(3-((2-mercaptoethyl)amino)-3-oxopropyl)-3,3-dimethyl-4-(phosphonooxy)butanamide; PNS; N(3)-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide; P-PantSH; AC1L3GTE; SCHEMBL106050; CHEBI:4222; JDMUPRLRUUMCTL-VIFPVBQESA-N; AKOS027326509; DB03912; C01134; Butanamide, 2-hydroxy-N-(3-((2-mercaptoethyl)a
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL |
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| Formula |
C11H23N2O7PS
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| Canonical SMILES |
CC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)NCCS)O
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| InChI |
1S/C11H23N2O7PS/c1-11(2,7-20-21(17,18)19)9(15)10(16)13-4-3-8(14)12-5-6-22/h9,15,22H,3-7H2,1-2H3,(H,12,14)(H,13,16)(H2,17,18,19)/t9-/m0/s1
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| InChIKey |
JDMUPRLRUUMCTL-VIFPVBQESA-N
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| CAS Number |
CAS 2226-71-3
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| PubChem Compound ID | ||||
| PubChem Substance ID |
4365, 828512, 830958, 832983, 6436763, 7889973, 11110335, 11110337, 11540516, 29296776, 46505104, 52105502, 57339082, 57578297, 57578298, 87692501, 104397967, 121269843, 126700491, 126920350, 131465140, 134213680, 134464829, 135073202, 135949313, 137031675, 137262145, 160966987, 161003610, 161003615, 161003621, 161003629, 161003634, 161003638, 161003643, 163716003, 164849420, 164849422, 182462003, 198953424, 204935363, 226480463, 241047082, 252449608
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| ChEBI ID |
CHEBI:4222
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Phosphopantetheine adenylyltransferase (PPAT) | Target Info | Inhibitor | [1] |
| KEGG Pathway | Pantothenate and CoA biosynthesis | |||
| Metabolic pathways | ||||
| WikiPathways | Metabolism of water-soluble vitamins and cofactors | |||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6. | |||
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