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Details

Stereochemistry ACHIRAL
Molecular Formula C22H14N4O4
Molecular Weight 398.371
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LAVENDAMYCIN

SMILES

CC1=C2C3=CC=CC=C3NC2=C(N=C1C(O)=O)C4=CC=C5C(=O)C=C(N)C(=O)C5=N4

InChI

InChIKey=IGQJRDIREIWBQP-UHFFFAOYSA-N
InChI=1S/C22H14N4O4/c1-9-16-10-4-2-3-5-13(10)24-20(16)19(26-17(9)22(29)30)14-7-6-11-15(27)8-12(23)21(28)18(11)25-14/h2-8,24H,23H2,1H3,(H,29,30)

HIDE SMILES / InChI

Molecular Formula C22H14N4O4
Molecular Weight 398.371
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
XL8988YP79
Record Status Validated (UNII)
Record Version