CC1C=C(N2C(S1)C(C2=O)NC(=O)C(=O)C3=CSC(=N3)NC=O)C(=O)O
الاسم: (6R)-7-[[2-(2-formamido-1,3-thiazol-4-yl)-2-oxoacetyl]amino]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES: CC1C=C(N2C(S1)C(C2=O)NC(=O)C(=O)C3=CSC(=N3)NC=O)C(=O)O

Molecular Processing

Molecular formula
C14H12N4O6S2
Molecular weight
396.41
Exact mass
396.0198
XLogP
-0.35
TPSA
145.77
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
91.47

Supplementary Information

InChIKey: HBHCUMJUPMFEAN-ANXXIGAQSA-N
مرادفات
HBHCUMJUPMFEAN-ANXXIGAQSA-N2-methyl-7-[2-(2-formylaminothiazol-4-yl)glyoxylamido]-3-cephem-4-carboxylic acid2-methyl-7-[2-(2-formylimino-2,3-dihydrothiazol-4-yl)glyoxylamido]-3-cephem-4-carboxylic acid
عرض المصدر →
مشارك في 4 تفاعل→

بحث موسع

بحث البنية الفرعية→بحث التشابه→