NHT

(3AR,5R,6S,7R,7AR)-2-(ETHYLAMINO)-5-(HYDROXYMETHYL)-5,6,7,7A-TETRAHYDRO-3AH-PYRANO[3,2-D][1,3]THIAZOLE-6,7-DIOL



Chemical Component Summary

Name(3AR,5R,6S,7R,7AR)-2-(ETHYLAMINO)-5-(HYDROXYMETHYL)-5,6,7,7A-TETRAHYDRO-3AH-PYRANO[3,2-D][1,3]THIAZOLE-6,7-DIOL
Identifiers(3aR,5R,6S,7R,7aR)-2-ethylamino-5-(hydroxymethyl)-5,6,7,7a-tetrahydro-3aH-pyrano[5,6-d][1,3]thiazole-6,7-diol
FormulaC9 H16 N2 O4 S
Molecular Weight248.299
TypeNON-POLYMER
Isomeric SMILESCCNC1=N[C@@H]2[C@H]([C@@H]([C@H](O[C@@H]2S1)CO)O)O
InChIInChI=1S/C9H16N2O4S/c1-2-10-9-11-5-7(14)6(13)4(3-12)15-8(5)16-9/h4-8,12-14H,2-3H2,1H3,(H,10,11)/t4-,5-,6-,7-,8-/m1/s1
InChIKeyPPAIMZHKIXDJRN-FMDGEEDCSA-N

Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count5
Bond Count33
Aromatic Bond Count0

Related Resource References

Resource NameReference
Pharos CHEMBL1213603
PubChem 135566354, 24808478
ChEMBL CHEMBL1213603