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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H38N8O13
Molecular Weight 610.5722
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-nitroso-streptomycin

SMILES

C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](NC(N)=N)[C@@H](O)[C@@H]2NC(N)=N)[C@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3N(C)N=O)[C@@]1(O)C=O

InChI

InChIKey=JFYDMNNWCOQYPF-HZYVHMACSA-N
InChI=1S/C21H38N8O13/c1-5-21(37,4-31)16(42-17-9(29(2)28-38)13(35)10(32)6(3-30)40-17)18(39-5)41-15-8(27-20(24)25)11(33)7(26-19(22)23)12(34)14(15)36/h4-18,30,32-37H,3H2,1-2H3,(H4,22,23,26)(H4,24,25,27)/t5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H38N8O13
Molecular Weight 610.5722
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 15 / 15
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
N6D6AM3RQS
Record Status Validated (UNII)
Record Version