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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H24N4O9
Molecular Weight 500.4581
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NOCARDICIN A

SMILES

N[C@H](CCOC1=CC=C(C=C1)C(=N\O)\C(=O)N[C@H]2CN([C@@H](C(O)=O)C3=CC=C(O)C=C3)C2=O)C(O)=O

InChI

InChIKey=CTNZOGJNVIFEBA-UPSUJEDGSA-N
InChI=1S/C23H24N4O9/c24-16(22(31)32)9-10-36-15-7-3-12(4-8-15)18(26-35)20(29)25-17-11-27(21(17)30)19(23(33)34)13-1-5-14(28)6-2-13/h1-8,16-17,19,28,35H,9-11,24H2,(H,25,29)(H,31,32)(H,33,34)/b26-18-/t16-,17+,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H24N4O9
Molecular Weight 500.4581
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
R76HLW7Z19
Record Status Validated (UNII)
Record Version