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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H20N4O4
Molecular Weight 248.2795
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEGAMYCIN

SMILES

CN(CC(O)=O)NC(=O)C[C@H](N)C[C@@H](O)CN

InChI

InChIKey=IKHFJPZQZVMLRH-RNFRBKRXSA-N
InChI=1S/C9H20N4O4/c1-13(5-9(16)17)12-8(15)3-6(11)2-7(14)4-10/h6-7,14H,2-5,10-11H2,1H3,(H,12,15)(H,16,17)/t6-,7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H20N4O4
Molecular Weight 248.2795
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

Substance Class Chemical
Record UNII
B15L87Q2HQ
Record Status Validated (UNII)
Record Version