Catalog Number:
AG003TCM
Chemical Name:
(S);-2-((tert-Butoxycarbonyl);amino);-6-(5-((3aS,4S,6aR);-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl);pentanamido);hexanoic acid
CAS Number:
62062-43-5
Molecular Formula:
C21H36N4O6S
Molecular Weight:
472.5987
MDL Number:
MFCD00133628
IUPAC Name:
(2S)-6-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
InChI:
InChI=1S/C21H36N4O6S/c1-21(2,3)31-20(30)24-13(18(27)28)8-6-7-11-22-16(26)10-5-4-9-15-17-14(12-32-15)23-19(29)25-17/h13-15,17H,4-12H2,1-3H3,(H,22,26)(H,24,30)(H,27,28)(H2,23,25,29)/t13-,14-,15-,17-/m0/s1
InChI Key:
XTQNFOCBPUXJCS-JKQORVJESA-N
SMILES:
O=C(CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2)NCCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C