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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H28N6O8
Molecular Weight 396.3968
Optical Activity ( + )
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZWITTERMICIN A, (+)-

SMILES

N[C@H](CO)[C@@H](O)C[C@H](O)[C@H](N)[C@H](O)[C@@H](O)C(=O)N[C@@H](CNC(N)=O)C(N)=O

InChI

InChIKey=FYIPKJHNWFVEIR-FXQWNPMTSA-N
InChI=1S/C13H28N6O8/c14-4(3-20)6(21)1-7(22)8(15)9(23)10(24)12(26)19-5(11(16)25)2-18-13(17)27/h4-10,20-24H,1-3,14-15H2,(H2,16,25)(H,19,26)(H3,17,18,27)/t4-,5+,6+,7+,8+,9+,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H28N6O8
Molecular Weight 396.3968
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
J5KML2XGC6
Record Status Validated (UNII)
Record Version