Chemical Component Summary

Name5-HYDROXYMETHYL-CHONDURITOL
Identifiers(1S,2S,3S,4R)-5-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol
FormulaC7 H12 O5
Molecular Weight176.167
TypeNON-POLYMER
Isomeric SMILESC1=C([C@H]([C@@H]([C@H]([C@H]1O)O)O)O)CO
InChIInChI=1S/C7H12O5/c8-2-3-1-4(9)6(11)7(12)5(3)10/h1,4-12H,2H2/t4-,5+,6-,7-/m0/s1
InChIKeyPJPGMULJEYSZBS-VZFHVOOUSA-N

Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count4
Bond Count24
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB03092 
Name5-Hydroxymethyl-Chonduritol
Groups experimental
Synonyms5-Hydroxymethyl-Chonduritol

Drug Targets

NameTarget SequencePharmacological ActionActions
Alpha-amylase 2BMKFFLLLFTIGFCWAQYSPNTQQGRTSIVHLFEWRWVDIALECERYLAPK...unknown
Alpha-amylase 1MKLFWLLFTIGFCWAQYSSNTQQGRTSIVHLFEWRWVDIALECERYLAPK...unknown
Pancreatic alpha-amylaseMKFFLLLFTIGFCWAQYSPNTQQGRTSIVHLFEWRWVDIALECERYLAPK...unknown
Pancreatic alpha-amylaseMKFFLLLFTIGFCWAQYSPNTQQGRTSIVHLFEWRWVDIALECERYLAPK...unknownligand
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 5288564
ChEMBL CHEMBL1233349