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Lactams

Organiske heterocykliske forbindelser, der indeholder et cyklisk amid; amidgrupper består af et carbonylcarbonatom forbundet med en enkeltbinding til et nitrogenatom og enten et hydrogen- eller et carbonatom. Disse forbindelser er nitrogenanaloger af lactoner.

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1

ε-Caprolactam, 99+%, Thermo Scientific Chemicals

CAS: 105-60-2 Molekylær formel: C6H11NO Molekylvægt (g/mol): 113.16 MDL nummer: MFCD00006936 InChI nøgle: JBKVHLHDHHXQEQ-UHFFFAOYSA-N Synonym: epsilon-caprolactam,caprolactam,6-caprolactam,2-oxohexamethylenimine,aminocaproic lactam,2-azacycloheptanone,hexahydro-2h-azepin-2-one,2h-azepin-2-one, hexahydro,6-hexanelactam,hexanolactam PubChem CID: 7768 ChEBI: CHEBI:28579 IUPAC navn: azepan-2-one SMIL: C1CCC(=O)NCC1

MDL nummer MFCD00006936
PubChem CID 7768
Molekylvægt (g/mol) 113.16
CAS 105-60-2
ChEBI CHEBI:28579
Synonym epsilon-caprolactam,caprolactam,6-caprolactam,2-oxohexamethylenimine,aminocaproic lactam,2-azacycloheptanone,hexahydro-2h-azepin-2-one,2h-azepin-2-one, hexahydro,6-hexanelactam,hexanolactam
SMIL C1CCC(=O)NCC1
IUPAC navn azepan-2-one
InChI nøgle JBKVHLHDHHXQEQ-UHFFFAOYSA-N
Molekylær formel C6H11NO
2

(-)-strychnin, 98 %, Thermo Scientific Chemicals

CAS: 57-24-9 Molekylær formel: C21H22N2O2 Molekylvægt (g/mol): 334.42 MDL nummer: MFCD00005941 InChI nøgle: QMGVPVSNSZLJIA-FVWCLLPLSA-N Synonym: strychnine,strychnidin-10-one,--strychnine,strychnin,3h strychnine,unii-h9y79vd43j,sanaseed,estricnina,strychinos,strychnos PubChem CID: 441071 ChEBI: CHEBI:28973 IUPAC navn: (4aR,5aS,8aR,13aS,15aS,15bR)-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-rolo[2,3-rolo[2,3-rolo[2,3-rolo[2,3] SMIL: O=C1C[C@@H]2OCC=C3CN4CC[C@@]56[C@@H]4C[C@@H]3[C@@H]2[C@@H]5N1C1=CC=CC=C61

MDL nummer MFCD00005941
PubChem CID 441071
Molekylvægt (g/mol) 334.42
CAS 57-24-9
ChEBI CHEBI:28973
Synonym strychnine,strychnidin-10-one,--strychnine,strychnin,3h strychnine,unii-h9y79vd43j,sanaseed,estricnina,strychinos,strychnos
SMIL O=C1C[C@@H]2OCC=C3CN4CC[C@@]56[C@@H]4C[C@@H]3[C@@H]2[C@@H]5N1C1=CC=CC=C61
IUPAC navn (4aR,5aS,8aR,13aS,15aS,15bR)-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-rolo[2,3-rolo[2,3-rolo[2,3-rolo[2,3]
InChI nøgle QMGVPVSNSZLJIA-FVWCLLPLSA-N
Molekylær formel C21H22N2O2
3

Brucin dihydrat, 99%, Thermo Scientific Chemicals

CAS: 145428-94-0 Molekylær formel: C23H27N2O4 Molekylvægt (g/mol): 395.48 MDL nummer: MFCD00005942 InChI nøgle: RRKTZKIUPZVBMF-IBTVXLQLSA-O Synonym: brucine dihydrate,10,11-dimethoxystrychnine,10,11-dimethoxystrychnine dihydrate PubChem CID: 69897601 IUPAC navn: (4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2 H-4,6-metanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-on;dihydrat SMIL: COC1=CC2=C(C=C1OC)[C@@]13CC[NH+]4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34

MDL nummer MFCD00005942
PubChem CID 69897601
Molekylvægt (g/mol) 395.48
CAS 145428-94-0
Synonym brucine dihydrate,10,11-dimethoxystrychnine,10,11-dimethoxystrychnine dihydrate
SMIL COC1=CC2=C(C=C1OC)[C@@]13CC[NH+]4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34
IUPAC navn (4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2 H-4,6-metanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-on;dihydrat
InChI nøgle RRKTZKIUPZVBMF-IBTVXLQLSA-O
Molekylær formel C23H27N2O4
4

N-methylcaprolactam, 96 %, Thermo Scientific Chemicals

CAS: 2556-73-2 Molekylær formel: C7H13NO Molekylvægt (g/mol): 127.187 MDL nummer: MFCD00003263 InChI nøgle: ZWXPDGCFMMFNRW-UHFFFAOYSA-N Synonym: n-methylcaprolactam,1-methylcaprolactam,n-methyl-.epsilon.-caprolactam,2h-azepin-2-one, hexahydro-1-methyl,n-methyl-e-caprolactam,epsilon-caprolactam, n-methyl,2h-azepin-2-one, hexahydro-n-methyl,hexahydro-n-methyl-2h-azepin-2-one,n-methyl-epsilon-caprolactam,n-methyl caprolactam PubChem CID: 17369 IUPAC navn: 1-methylazepan-2-on SMIL: CN1CCCCCC1=O

MDL nummer MFCD00003263
PubChem CID 17369
Molekylvægt (g/mol) 127.187
CAS 2556-73-2
Synonym n-methylcaprolactam,1-methylcaprolactam,n-methyl-.epsilon.-caprolactam,2h-azepin-2-one, hexahydro-1-methyl,n-methyl-e-caprolactam,epsilon-caprolactam, n-methyl,2h-azepin-2-one, hexahydro-n-methyl,hexahydro-n-methyl-2h-azepin-2-one,n-methyl-epsilon-caprolactam,n-methyl caprolactam
SMIL CN1CCCCCC1=O
IUPAC navn 1-methylazepan-2-on
InChI nøgle ZWXPDGCFMMFNRW-UHFFFAOYSA-N
Molekylær formel C7H13NO
5

epsilon-Caprolactam, 99 %, Thermo Scientific Chemicals

CAS: 105-60-2 Molekylær formel: C6H11NO Molekylvægt (g/mol): 113.16 MDL nummer: MFCD00006936 InChI nøgle: JBKVHLHDHHXQEQ-UHFFFAOYSA-N Synonym: epsilon-caprolactam,caprolactam,6-caprolactam,2-oxohexamethylenimine,aminocaproic lactam,2-azacycloheptanone,hexahydro-2h-azepin-2-one,2h-azepin-2-one, hexahydro,6-hexanelactam,hexanolactam PubChem CID: 7768 ChEBI: CHEBI:28579 IUPAC navn: azepan-2-one SMIL: C1CCC(=O)NCC1

MDL nummer MFCD00006936
PubChem CID 7768
Molekylvægt (g/mol) 113.16
CAS 105-60-2
ChEBI CHEBI:28579
Synonym epsilon-caprolactam,caprolactam,6-caprolactam,2-oxohexamethylenimine,aminocaproic lactam,2-azacycloheptanone,hexahydro-2h-azepin-2-one,2h-azepin-2-one, hexahydro,6-hexanelactam,hexanolactam
SMIL C1CCC(=O)NCC1
IUPAC navn azepan-2-one
InChI nøgle JBKVHLHDHHXQEQ-UHFFFAOYSA-N
Molekylær formel C6H11NO
6

2,4-piperidindion, 97 %, Thermo Scientific Chemicals

CAS: 50607-30-2 InChI nøgle: RDNZDMDLRIQQAX-UHFFFAOYSA-N PubChem CID: 10887863 IUPAC navn: piperidin-2,4-dion SMIL: C1CNC(=O)CC1=O

PubChem CID 10887863
CAS 50607-30-2
SMIL C1CNC(=O)CC1=O
IUPAC navn piperidin-2,4-dion
InChI nøgle RDNZDMDLRIQQAX-UHFFFAOYSA-N
7

Brucinsulfathydrat, 98% (tørvægt), vand< 13 %, Thermo Scientific Chemicals

CAS: 652154-10-4 Molekylær formel: C46H54N4O12S Molekylvægt (g/mol): 887.01 MDL nummer: MFCD00013472 InChI nøgle: HCMSIGALSOEZRW-MDQLRNFDSA-N Synonym: brucine sulfate salt PubChem CID: 118797651 IUPAC navn: 10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolinsulfursyre-14-hydrat; SMIL: OS(O)(=O)=O.[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C([C@@]35[H])[C@]1(CCN2C4)C1=C6C=C(OC)C(OC)=C1.[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C([C@@]35[H])[C@]1(CCN2C4)C1=C6C=C(OC)C(OC)=C1

MDL nummer MFCD00013472
PubChem CID 118797651
Molekylvægt (g/mol) 887.01
CAS 652154-10-4
Synonym brucine sulfate salt
SMIL OS(O)(=O)=O.[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C([C@@]35[H])[C@]1(CCN2C4)C1=C6C=C(OC)C(OC)=C1.[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C([C@@]35[H])[C@]1(CCN2C4)C1=C6C=C(OC)C(OC)=C1
IUPAC navn 10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolinsulfursyre-14-hydrat;
InChI nøgle HCMSIGALSOEZRW-MDQLRNFDSA-N
Molekylær formel C46H54N4O12S
8

Thermo Scientific Chemicals Sulbactam

CAS: 68373-14-8 Molekylær formel: C8H11NO5S Molekylvægt (g/mol): 233.24 InChI nøgle: FKENQMMABCRJMK-RITPCOANSA-N Synonym: sulbactam,sulbactam acid,penicillanic acid sulfone,sulbactamum,betamaze,2s,5r-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo 3.2.0 heptane-2-carboxylic acid 4,4-dioxide,penicillanic acid 1,1-dioxide,unii-s4tf6i2330,penicillanic acid dioxide,chembl403 PubChem CID: 130313 ChEBI: CHEBI:9321 IUPAC navn: (2S,5R)-3,3-dimethyl-4,4,7-trioxo-4$1^{6}-thia-1-azabicyclo[3.2.0]heptan-2-carboxylsyre SMIL: CC1(C)[C@@H](N2[C@@H](CC2=O)S1(=O)=O)C(O)=O

PubChem CID 130313
Molekylvægt (g/mol) 233.24
CAS 68373-14-8
ChEBI CHEBI:9321
Synonym sulbactam,sulbactam acid,penicillanic acid sulfone,sulbactamum,betamaze,2s,5r-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo 3.2.0 heptane-2-carboxylic acid 4,4-dioxide,penicillanic acid 1,1-dioxide,unii-s4tf6i2330,penicillanic acid dioxide,chembl403
SMIL CC1(C)[C@@H](N2[C@@H](CC2=O)S1(=O)=O)C(O)=O
IUPAC navn (2S,5R)-3,3-dimethyl-4,4,7-trioxo-4$1^{6}-thia-1-azabicyclo[3.2.0]heptan-2-carboxylsyre
InChI nøgle FKENQMMABCRJMK-RITPCOANSA-N
Molekylær formel C8H11NO5S
9

7-Aminocephalosporanic acid, 95-102%

CAS: 957-68-6 Molekylær formel: C10H12N2O5S Molekylvægt (g/mol): 272.27 MDL nummer: MFCD00005177 InChI nøgle: HSHGZXNAXBPPDL-HZGVNTEJSA-N Synonym: 7-aminocephalosporanic acid,7-aca,7-aminocephalosporinic acid,7beta-aminocephalosporanic acid,7-acs,unii-9xi67897rg,7r-7-aminocephalosporanic acid,7r-7-aminocephalosporanate,cephalosporanic acid, 7-amino,6r,7r-3-acetoxymethyl-7-amino-8-oxo-5-thia-1-azabicyclo 4.2.0 oct-2-ene-2-carboxylic acid PubChem CID: 441328 ChEBI: CHEBI:2255 IUPAC navn: (6R,7R)-3-(acetyloxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-carboxylsyre SMIL: CC(=O)OCC1=C(N2C(C(C2=O)N)SC1)C(=O)O

MDL nummer MFCD00005177
PubChem CID 441328
Molekylvægt (g/mol) 272.27
CAS 957-68-6
ChEBI CHEBI:2255
Synonym 7-aminocephalosporanic acid,7-aca,7-aminocephalosporinic acid,7beta-aminocephalosporanic acid,7-acs,unii-9xi67897rg,7r-7-aminocephalosporanic acid,7r-7-aminocephalosporanate,cephalosporanic acid, 7-amino,6r,7r-3-acetoxymethyl-7-amino-8-oxo-5-thia-1-azabicyclo 4.2.0 oct-2-ene-2-carboxylic acid
SMIL CC(=O)OCC1=C(N2C(C(C2=O)N)SC1)C(=O)O
IUPAC navn (6R,7R)-3-(acetyloxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-carboxylsyre
InChI nøgle HSHGZXNAXBPPDL-HZGVNTEJSA-N
Molekylær formel C10H12N2O5S
10

4-Acetoxy-2-azetidinone, 97%, Thermo Scientific Chemicals

CAS: 28562-53-0 Molekylær formel: C5H7NO3 Molekylvægt (g/mol): 129.12 MDL nummer: MFCD00010593 InChI nøgle: OEYMQQDJCUHKQS-UHFFFAOYNA-N Synonym: 4-acetoxy-2-azetidinone,2-azetidinone, 4-acetyloxy,4-acetoxyazetidinone,4-oxoazetidin-2-yl acetate,2-oxoazetidinium 4-acetate,2-azetidinone, 4-acetyloxy-, 4r,4-acetoxy-azetidinone,acmc-20bsq9,4-acetoxyazetidin-2-one,4-acetoxyazetidine-2-one PubChem CID: 119981 IUPAC navn: (4-oxoazetidin-2-yl) acetate SMIL: CC(=O)OC1CC(=O)N1

MDL nummer MFCD00010593
PubChem CID 119981
Molekylvægt (g/mol) 129.12
CAS 28562-53-0
Synonym 4-acetoxy-2-azetidinone,2-azetidinone, 4-acetyloxy,4-acetoxyazetidinone,4-oxoazetidin-2-yl acetate,2-oxoazetidinium 4-acetate,2-azetidinone, 4-acetyloxy-, 4r,4-acetoxy-azetidinone,acmc-20bsq9,4-acetoxyazetidin-2-one,4-acetoxyazetidine-2-one
SMIL CC(=O)OC1CC(=O)N1
IUPAC navn (4-oxoazetidin-2-yl) acetate
InChI nøgle OEYMQQDJCUHKQS-UHFFFAOYNA-N
Molekylær formel C5H7NO3