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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H31N3O10S
Molecular Weight 517.55
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of p-Nitrophenyl N<sup>2</sup>-(tert-butoxycarbonyl)-N<sup>6</sup>-[[2-(methylsulfonyl)ethoxy]carbonyl]-L-lysinate

SMILES

CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)OCCS(C)(=O)=O)C(=O)OC1=CC=C(C=C1)[N+]([O-])=O

InChI

InChIKey=AMMIWIHTJFNQDK-KRWDZBQOSA-N
InChI=1S/C21H31N3O10S/c1-21(2,3)34-20(27)23-17(18(25)33-16-10-8-15(9-11-16)24(28)29)7-5-6-12-22-19(26)32-13-14-35(4,30)31/h8-11,17H,5-7,12-14H2,1-4H3,(H,22,26)(H,23,27)/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H31N3O10S
Molecular Weight 517.55
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
BYB7H7QX46
Record Status Validated (UNII)
Record Version