Account (2-((S)-2-((S)-2-((2S,3S)-2-((S)-2-((1S,4S,7S,8S,11R,14S,17R,20S)-7-((S)-6-amino-2-((S)-2-((S)-4-amino-2-((3R,9S,12S,15S,21S,22S)-21-((S)-6-amino-2-((6R,9S,10S,15aS)-10-((3R,6S,12S,15S)-15-((Z)-2-((2S,3S)-2-amino-3-methylpentanamido)but-2-enamido)-12-((S)-sec-butyl)-6-isobutyl-9-methylene-5,8,11,14-tetraoxo-1-thia-4,7,10,13-tetraazacyclohexadecane-3-carboxamido)-9-methyl-1,4,11-trioxododecahydro-1H,9H-pyrrolo[2,1-i][1]thia[4,7,10]triazacyclotridecine-6-carboxamido)hexanamido)-12-isobutyl-15,22-dimethyl-9-(2-(methylthio)ethyl)-5,8,11,14,17,20-hexaoxo-1-thia-4,7,10,13,16,19-hexaazacyclodocosane-3-carboxamido)-4-oxobutanamido)-4-(methylthio)butanamido)hexanamido)-14-(2-amino-2-oxoethyl)-4,8,20-trimethyl-3,6,12,15,21-pentaoxo-9,19-dithia-2,5,13,16,22-pentaazabicyclo[9.9.2]docosane-17-carboxamido)-3-hydroxypropanamido)-3-methylpentanamido)-3-(1H-imidazol-5-yl)propanamido)-3-methylbutanamido)acryloyl)-L-lysine
- Catalog No. :
- ACEQQM617
- CAS No. :
- 137061-46-2
- Molecular Formula :
- C141H229N41O38S7
- Molecular Weight :
- 3331.10
IUPAC Name:(2-((S)-2-((S)-2-((2S,3S)-2-((S)-2-((1S,4S,7S,8S,11R,14S,17R,20S)-7-((S)-6-amino-2-((S)-2-((S)-4-amino-2-((3R,9S,12S,15S,21S,22S)-21-((S)-6-amino-2-((6R,9S,10S,15aS)-10-((3R,6S,12S,15S)-15-((Z)-2-((2S,3S)-2-amino-3-methylpentanamido)but-2-enamido)-12-((S)-sec-butyl)-6-isobutyl-9-methylene-5,8,11,14-tetraoxo-1-thia-4,7,10,13-tetraazacyclohexadecane-3-carboxamido)-9-methyl-1,4,11-trioxododecahydro-1H,9H-pyrrolo[2,1-i][1]thia[4,7,10]triazacyclotridecine-6-carboxamido)hexanamido)-12-isobutyl-15,22-dimethyl-9-(2-(methylthio)ethyl)-5,8,11,14,17,20-hexaoxo-1-thia-4,7,10,13,16,19-hexaazacyclodocosane-3-carboxamido)-4-oxobutanamido)-4-(methylthio)butanamido)hexanamido)-14-(2-amino-2-oxoethyl)-4,8,20-trimethyl-3,6,12,15,21-pentaoxo-9,19-dithia-2,5,13,16,22-pentaazabicyclo[9.9.2]docosane-17-carboxamido)-3-hydroxypropanamido)-3-methylpentanamido)-3-(1H-imidazol-5-yl)propanamido)-3-methylbutanamido)acryloyl)-L-lysine
![(2-((S)-2-((S)-2-((2S,3S)-2-((S)-2-((1S,4S,7S,8S,11R,14S,17R,20S)-7-((S)-6-amino-2-((S)-2-((S)-4-amino-2-((3R,9S,12S,15S,21S,22S)-21-((S)-6-amino-2-((6R,9S,10S,15aS)-10-((3R,6S,12S,15S)-15-((Z)-2-((2S,3S)-2-amino-3-methylpentanamido)but-2-enamido)-12-((S)-sec-butyl)-6-isobutyl-9-methylene-5,8,11,14-tetraoxo-1-thia-4,7,10,13-tetraazacyclohexadecane-3-carboxamido)-9-methyl-1,4,11-trioxododecahydro-1H,9H-pyrrolo[2,1-i][1]thia[4,7,10]triazacyclotridecine-6-carboxamido)hexanamido)-12-isobutyl-15,22-dimethyl-9-(2-(methylthio)ethyl)-5,8,11,14,17,20-hexaoxo-1-thia-4,7,10,13,16,19-hexaazacyclodocosane-3-carboxamido)-4-oxobutanamido)-4-(methylthio)butanamido)hexanamido)-14-(2-amino-2-oxoethyl)-4,8,20-trimethyl-3,6,12,15,21-pentaoxo-9,19-dithia-2,5,13,16,22-pentaazabicyclo[9.9.2]docosane-17-carboxamido)-3-hydroxypropanamido)-3-methylpentanamido)-3-(1H-imidazol-5-yl)propanamido)-3-methylbutanamido)acryloyl)-L-lysine structure diagram](/images/productimg/no-pic.svg)
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| Product Name | (2-((S)-2-((S)-2-((2S,3S)-2-((S)-2-((1S,4S,7S,8S,11R,14S,17R,20S)-7-((S)-6-amino-2-((S)-2-((S)-4-amino-2-((3R,9S,12S,15S,21S,22S)-21-((S)-6-amino-2-((6R,9S,10S,15aS)-10-((3R,6S,12S,15S)-15-((Z)-2-((2S,3S)-2-amino-3-methylpentanamido)but-2-enamido)-12-((S)-sec-butyl)-6-isobutyl-9-methylene-5,8,11,14-tetraoxo-1-thia-4,7,10,13-tetraazacyclohexadecane-3-carboxamido)-9-methyl-1,4,11-trioxododecahydro-1H,9H-pyrrolo[2,1-i][1]thia[4,7,10]triazacyclotridecine-6-carboxamido)hexanamido)-12-isobutyl-15,22-dimethyl-9-(2-(methylthio)ethyl)-5,8,11,14,17,20-hexaoxo-1-thia-4,7,10,13,16,19-hexaazacyclodocosane-3-carboxamido)-4-oxobutanamido)-4-(methylthio)butanamido)hexanamido)-14-(2-amino-2-oxoethyl)-4,8,20-trimethyl-3,6,12,15,21-pentaoxo-9,19-dithia-2,5,13,16,22-pentaazabicyclo[9.9.2]docosane-17-carboxamido)-3-hydroxypropanamido)-3-methylpentanamido)-3-(1H-imidazol-5-yl)propanamido)-3-methylbutanamido)acryloyl)-L-lysine |
|---|---|
| IUPAC Name | (2-((S)-2-((S)-2-((2S,3S)-2-((S)-2-((1S,4S,7S,8S,11R,14S,17R,20S)-7-((S)-6-amino-2-((S)-2-((S)-4-amino-2-((3R,9S,12S,15S,21S,22S)-21-((S)-6-amino-2-((6R,9S,10S,15aS)-10-((3R,6S,12S,15S)-15-((Z)-2-((2S,3S)-2-amino-3-methylpentanamido)but-2-enamido)-12-((S)-sec-butyl)-6-isobutyl-9-methylene-5,8,11,14-tetraoxo-1-thia-4,7,10,13-tetraazacyclohexadecane-3-carboxamido)-9-methyl-1,4,11-trioxododecahydro-1H,9H-pyrrolo[2,1-i][1]thia[4,7,10]triazacyclotridecine-6-carboxamido)hexanamido)-12-isobutyl-15,22-dimethyl-9-(2-(methylthio)ethyl)-5,8,11,14,17,20-hexaoxo-1-thia-4,7,10,13,16,19-hexaazacyclodocosane-3-carboxamido)-4-oxobutanamido)-4-(methylthio)butanamido)hexanamido)-14-(2-amino-2-oxoethyl)-4,8,20-trimethyl-3,6,12,15,21-pentaoxo-9,19-dithia-2,5,13,16,22-pentaazabicyclo[9.9.2]docosane-17-carboxamido)-3-hydroxypropanamido)-3-methylpentanamido)-3-(1H-imidazol-5-yl)propanamido)-3-methylbutanamido)acryloyl)-L-lysine |
| MDL No. | MFCD35244784 |
| Molecular Formula | C141H229N41O38S7 |
| Molecular Weight | 3331.10 |
| SMILES | C=C(NC(=O)[C@@H](NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CS[C@@H](C)[C@H]2NC(=O)[C@H](C)NC(=O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]3CS[C@@H](C)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]4CS[C@@H](C)[C@@H](NC(=O)[C@@H]5CSC[C@@H](NC(=O)/C(=C/C)NC(=O)[C@@H](N)[C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NC(=C)C(=O)N[C@@H](CC(C)C)C(=O)N5)C(=O)N5CCC[C@H]5C(=O)NCC(=O)N4)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N3)[C@H](C)SC[C@H](NC2=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O |
| InChI Key | PWFSAVZKCGCNRK-RDLXCTAXSA-N |
| Synonym | nisin Z;Nisin A, 27-L-asparagine-;Nisin Z (~80%) DISCONTINUED. Please see N487558. |
| CAS No. | 137061-46-2 |
Synthetic Route by SureRoute
2. ACEQQM617 Molecular Building Block Synthetic Route
((4R,7S,10S,13S,16S,19R)-19-((S)-4-amino-2-((S)-2-((S)-6-amino-2-((S)-2-((S)-2-amino-4-methylpentanamido)-5-guanidinopentanamido)hexanamido)-3-(1H-imidazol-4-yl)propanamido)-4-oxobutanamido)-13-(3-amino-3-oxopropyl)-7,10-bis(3-guanidinopropyl)-16-isobutyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)-L-methionyl-L-prolyl-L-leucyl-L-histidyl-L-seryl-L-arginyl-L-valyl-L-prolyl-L-phenylalanyl-L-proline
-
3-((3S,6R,9S,12S,15S,18S,21S,24S,27S,30R,35R,38S,41S,46aS,49R)-9,18-bis((1H-imidazol-4-yl)methyl)-24,41-bis(2-amino-2-oxoethyl)-49-(2-aminoacetamido)-30-carbamoyl-21,38-bis(hydroxymethyl)-12,27-diisobutyl-3-isopropyl-1,4,7,10,13,16,19,22,25,28,36,39,42,48-tetradecaoxodotetracontahydro-1H,34H-35,6-(epiminopropanodithiomethano)pyrrolo[2,1-h1][1,2]dithia[5,8,11,14,17,20,23,26,29,32,35,38,41]tridecaazacyclotetratetracontin-15-yl)propanoic acid