Ketcher 03121815012D 1 1.00000 0.00000 0 39 43 0 1 0 999 V2000 13.8612 -55.3843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9951 -54.8842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9951 -53.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8612 -53.3843 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.7271 -53.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7271 -54.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9952 -53.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9952 -54.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2880 -55.5914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8612 -56.3843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7271 -56.8843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9951 -56.8843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5932 -55.3843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4593 -54.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5637 -53.8897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5420 -53.6819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0420 -54.5479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.3729 -55.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5808 -56.2691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0364 -54.6524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7056 -53.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6191 -54.3159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.5145 -55.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5365 -55.5185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5364 -53.7863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1291 -53.3843 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 -53.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3971 -53.3843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 -54.8842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5310 -53.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3971 -52.3842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 -51.8843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4265 -54.8788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4483 -55.0867 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9484 -54.2206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6174 -53.4776 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9539 -54.1162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9951 -52.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9952 -52.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 6 2 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 7 8 1 0 0 0 8 2 1 0 0 0 3 7 1 0 0 0 8 9 2 0 0 0 1 10 1 0 0 0 10 11 1 0 0 0 10 12 2 0 0 0 6 13 1 0 0 0 13 14 2 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 14 15 1 0 0 0 14 18 1 0 0 0 18 19 2 0 0 0 20 17 1 1 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 20 21 1 0 0 0 20 24 1 0 0 0 20 25 1 6 0 0 7 26 1 1 0 0 26 27 1 0 0 0 27 28 1 0 0 0 27 29 2 0 0 0 28 30 1 0 0 0 28 31 2 0 0 0 31 32 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 2 0 0 0 30 33 2 0 0 0 30 36 1 0 0 0 35 37 1 0 0 0 3 38 1 6 0 0 7 39 1 6 0 0 M END > CHEBI:140407 > ceftobiprole > A fifth-generation cephalosporin antibiotic having (E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl and [(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino side groups located at positions 3 and 7 respectively; developed for the treatment of hospital-acquired pneumonia (HAP, excluding ventilator-associated pneumonia, VAP) and community-acquired pneumonia (CAP). > 3 > (6R,7R)-7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-8-oxo-3-{(E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid > 7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-3-{(E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl}-3,4-didehydrocepham-4-carboxylic acid > ceftobiprolum; ceftobiprole; ceftobiprole; ceftobiprol > C20H22N8O6S2 > 534.572 > 534.11037 > 0 > C=1(N2[C@](SCC1/C=C/3\CCN(C3=O)[C@]4(CNCC4)[H])([C@@](C2=O)(NC(/C(/C5=NSC(=N5)N)=N\O)=O)[H])[H])C(O)=O > InChI=1S/C20H22N8O6S2/c21-20-24-14(26-36-20)11(25-34)15(29)23-12-17(31)28-13(19(32)33)9(7-35-18(12)28)5-8-2-4-27(16(8)30)10-1-3-22-6-10/h5,10,12,18,22,34H,1-4,6-7H2,(H,23,29)(H,32,33)(H2,21,24,26)/b8-5+,25-11-/t10-,12-,18-/m1/s1 > VOAZJEPQLGBXGO-SDAWRPRTSA-N > 209467-52-7 > 9105776 > 209467-52-7 > D08885 > PMC5631058 > 25753637; 26316697; 26443816; 28264613; 29017833; 29395713; 29452992 $$$$