CAS Registry Number®
124832-31-1
CAS Name
N-[(Phenylmethoxy)carbonyl]-L-valine 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]ethyl ester
Molecular Formula
C21H26N6O6
Molecular Mass
458.47
Other Names and Identifiers
InChI
InChI=1S/C21H26N6O6/c1-13(2)15(24-21(30)33-10-14-6-4-3-5-7-14)19(29)32-9-8-31-12-27-11-23-16-17(27)25-20(22)26-18(16)28/h3-7,11,13,15H,8-10,12H2,1-2H3,(H,24,30)(H3,22,25,26,28)/t15-/m0/s1
InChIKey
InChIKey=ZQSUAJRZJTUOEA-HNNXBMFYSA-N
SMILES
C(OCCOC([C@@H](NC(OCC1=CC=CC=C1)=O)C(C)C)=O)N2C3=C(N=C2)C(=O)N=C(N)N3
Canonical SMILES
O=C1N=C(N)NC2=C1N=CN2COCCOC(=O)C(NC(=O)OCC=3C=CC=CC3)C(C)C
Other Names for this Substance
- L-Valine, N-[(phenylmethoxy)carbonyl]-, 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]ethyl ester
- N-[(Phenylmethoxy)carbonyl]-L-valine 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]ethyl ester
- (S)-2-((2-Imino-6-oxo-2,3-dihydro-1H-purin-9(6H)-yl)methoxy)ethyl 2-(((benzyloxy)carbonyl)amino)-3-methylbutanoate
Deleted or Replaced CAS Registry Numbers
1254172-19-4
