Chemical Component Summary

NamePANTOTHENYL-AMINOETHANOL-11-PIVALIC ACID
Identifiers[(3R)-3-hydroxy-4-[[3-(2-hydroxyethylamino)-3-oxo-propyl]amino]-2,2-dimethyl-4-oxo-butyl] 2,2-dimethylpropanoate
FormulaC16 H30 N2 O6
Molecular Weight346.419
TypeNON-POLYMER
Isomeric SMILESCC(C)(C)C(=O)OCC(C)(C)[C@H](C(=O)NCCC(=O)NCCO)O
InChIInChI=1S/C16H30N2O6/c1-15(2,3)14(23)24-10-16(4,5)12(21)13(22)18-7-6-11(20)17-8-9-19/h12,19,21H,6-10H2,1-5H3,(H,17,20)(H,18,22)/t12-/m0/s1
InChIKeyBUEKNBNKVUKNIB-LBPRGKRZSA-N

Chemical Details

Formal Charge0
Atom Count54
Chiral Atom Count1
Bond Count53
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB08328 
NamePANTOTHENYL-AMINOETHANOL-11-PIVALIC ACID
Groups experimental
SynonymsPANTOTHENYL-AMINOETHANOL-11-PIVALIC ACID

Drug Targets

NameTarget SequencePharmacological ActionActions
Acetyl-CoA acetyltransferaseMSTPSIVIASARTAVGSFNGAFANTPAHELGATVISAVLERAGVAAGEVN...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 25011726