Account 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
- Catalog No. :
- ACOUQE574
- CAS No. :
- 175735-93-0
- Molecular Formula :
- C67H103N23O22S4
- Molecular Weight :
- 1710.97
IUPAC Name: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
![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 structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 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 |
|---|---|
| IUPAC Name | 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 |
| Molecular Formula | C67H103N23O22S4 |
| Molecular Weight | 1710.97 |
| SMILES | CC(C)C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC2=CNC=N2)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=CNC=N2)NC(=O)[C@@H]2CSSC[C@H](NC(=O)CN)C(=O)N[C@@H](CSSC[C@@H](C(N)=O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N2 |
| InChI Key | DUQYFGMBLOPGBY-XCQLYXDWSA-N |
| Synonym | α-Conotoxin MII;L-Cysteinamide, glycyl-L-cysteinyl-L-cysteinyl-L-seryl-L-asparaginyl-L-prolyl-L-valyl-L-cysteinyl-L-histidyl-L-leucyl-L-α-glutamyl-L-histidyl-L-seryl-L-asparaginyl-L-leucyl-, cyclic (2→8),(3→16)-bis(disulfide);α-Conotoxin MII |
| CAS No. | 175735-93-0 |
Synthetic Route by SureRoute
2. ACOUQE574 Molecular Building Block Synthetic Route
3-((3S,6S,9S,12S,15R,18S,21S,24S,27R,32R,35S,38S,43aS,46S,49R)-49-amino-27-(((S)-5-amino-1-(((S)-5-amino-1-(((S)-1-amino-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl)amino)-1,5-dioxopentan-2-yl)amino)-1,5-dioxopentan-2-yl)carbamoyl)-46-(2-amino-2-oxoethyl)-35-(4-aminobutyl)-21,24-bis(3-guanidinopropyl)-6-((R)-1-hydroxyethyl)-12-isobutyl-9,18,38-trimethyl-1,4,7,10,13,16,19,22,25,33,36,39,45,48-tetradecaoxotetracontahydro-31H-32,15-(epiminoethanoiminopropanodithiomethano)pyrrolo[2,1-e1][1,2]dithia[5,8,11,14,17,20,23,26,29,32,35,38]dodecaazacyclohentetracontin-3-yl)propanoic acid
Calcitonin Salmon
(S)-2-((R)-2-((S)-2-((S)-2-((S)-1-Acetylpyrrolidine-2-carboxamido)-3-(1H-imidazol-4-yl)propanamido)-3-hydroxypropanamido)-3-mercaptopropanamido)succinamide