Account (4R,7R,10S,13S,19S,E)-7-((1H-Indol-3-yl)methyl)-10-(4-aminobutyl)-4-(4-hydroxyphenyl)-8,13,15,19-tetramethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetraone
- Catalog No. :
- ACSFMV084
- CAS No. :
- 1377338-39-0
- Molecular Formula :
- C38H51N5O6
- Molecular Weight :
- 673.85
IUPAC Name:(4R,7R,10S,13S,19S,E)-7-((1H-indol-3-yl)methyl)-10-(4-aminobutyl)-4-(4-hydroxyphenyl)-8,13,15,19-tetramethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetraone
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Product Information
| Product Name | (4R,7R,10S,13S,19S,E)-7-((1H-Indol-3-yl)methyl)-10-(4-aminobutyl)-4-(4-hydroxyphenyl)-8,13,15,19-tetramethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetraone |
|---|---|
| IUPAC Name | (4R,7R,10S,13S,19S,E)-7-((1H-indol-3-yl)methyl)-10-(4-aminobutyl)-4-(4-hydroxyphenyl)-8,13,15,19-tetramethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetraone |
| Molecular Formula | C38H51N5O6 |
| Molecular Weight | 673.85 |
| SMILES | C/C1=C\CC[C@H](C)OC(=O)C[C@H](C2=CC=C(O)C=C2)NC(=O)[C@@H](CC2=CNC3=C2C=CC=C3)N(C)C(=O)[C@H](CCCCN)NC(=O)[C@@H](C)C1 |
| InChI Key | RQHFNHYDHSLEGQ-BKFNPDDGSA-N |
| Synonym | Cyclo[(3R)-3-(4-hydroxyphenyl)-β-alanyl-(2S,4E,8S)-8-hydroxy-2,4-dimethyl-4-nonenoyl-L-lysyl-N-methyl-D-tryptophyl] |
| CAS No. | 1377338-39-0 |
Synthetic Route by SureRoute
2. ACSFMV084 Molecular Building Block Synthetic Route
Cyclo[(3R)-3-(4-hydroxyphenyl)-β-alanyl-(2S,4E,6R,8S)-8-hydroxy-2,4,6-trimethyl-4-nonenoyl-L-alanyl-2-bromo-N-methyl-D-tryptophyl]
Methyl (R)-3-((R)-2-((S)-2-amino-N-methylpropanamido)-3-(2-bromo-1H-indol-3-yl)propanamido)-3-(4-((triisopropylsilyl)oxy)phenyl)propanoate
(3S,6R,9S,12S,15S,19R,20aS)-6-((1H-indol-3-yl)methyl)-9-(4-aminobutyl)-15-benzyl-12-(4-(benzyloxy)benzyl)-1,4,7,10,13,16-hexaoxo-3-phenylicosahydropyrrolo[1,2-a][1,4,7,10,13,16]hexaazacyclooctadecin-19-yl (2-aminoethyl)carbamate acetate