Account (R)-N-((S)-5-Amino-1-(((2R,3S)-1-(((3S,9S,12R,15R,18R,19R,Z)-9-benzyl-15-((S)-sec-butyl)-6-ethylidene-3,12-diisopropyl-19-methyl-2,5,8,11,14,17-hexaoxo-1-oxa-4,7,10,13,16-pentaazacyclononadecan-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-((2R,5S,8S,11R,16S)-8-((R)-1-hydroxyethyl)-2,5,11-triisopropyl-16-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaoctadecan-1-oyl)pyrrolidine-2-carboxamide
- Catalog No. :
- ACANFV357
- CAS No. :
- 681272-30-0
- Molecular Formula :
- C75H124N14O16
- Molecular Weight :
- 1477.90
IUPAC Name:(R)-N-((S)-5-amino-1-(((2R,3S)-1-(((3S,9S,12R,15R,18R,19R,Z)-9-benzyl-15-((S)-sec-butyl)-6-ethylidene-3,12-diisopropyl-19-methyl-2,5,8,11,14,17-hexaoxo-1-oxa-4,7,10,13,16-pentaazacyclononadecan-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-(((S)-4-methylhexanoyl)-D-valyl-L-threonyl-L-valyl-D-valyl)pyrrolidine-2-carboxamide
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Product Information
| Product Name | (R)-N-((S)-5-Amino-1-(((2R,3S)-1-(((3S,9S,12R,15R,18R,19R,Z)-9-benzyl-15-((S)-sec-butyl)-6-ethylidene-3,12-diisopropyl-19-methyl-2,5,8,11,14,17-hexaoxo-1-oxa-4,7,10,13,16-pentaazacyclononadecan-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-((2R,5S,8S,11R,16S)-8-((R)-1-hydroxyethyl)-2,5,11-triisopropyl-16-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaoctadecan-1-oyl)pyrrolidine-2-carboxamide |
|---|---|
| IUPAC Name | (R)-N-((S)-5-amino-1-(((2R,3S)-1-(((3S,9S,12R,15R,18R,19R,Z)-9-benzyl-15-((S)-sec-butyl)-6-ethylidene-3,12-diisopropyl-19-methyl-2,5,8,11,14,17-hexaoxo-1-oxa-4,7,10,13,16-pentaazacyclononadecan-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-(((S)-4-methylhexanoyl)-D-valyl-L-threonyl-L-valyl-D-valyl)pyrrolidine-2-carboxamide |
| Molecular Formula | C75H124N14O16 |
| Molecular Weight | 1477.90 |
| SMILES | CC[C@H](C)CCC(N[C@H](C(C)C)C(N[C@@H]([C@H](O)C)C(N[C@@H](C(C)C)C(N[C@H](C(C)C)C(N1[C@H](CCC1)C(N[C@@H](CCCN)C(N[C@H]([C@@H](C)CC)C(N[C@H]2C(N[C@](C(N[C@@H](C(N[C@H](C(N/C(C(N[C@H](C(O[C@@H]2C)=O)C(C)C)=O)=C\C)=O)CC3=CC=CC=C3)=O)C(C)C)=O)([H])[C@@H](C)CC)=O)=O)=O)=O)=O)=O)=O)=O)=O |
| InChI Key | ZNVCPJPCKSJWDH-UCTDCHLSSA-N |
| Synonym | ZNVCPJPCKSJWDH-DUXKOPKSSA-N;Elisidepsin;Irvalec;Isokahalalide F;PM 02734;L-Valine, N-[(4S)-4-methyl-1-oxohexyl]-D-valyl-L-threonyl-L-valyl-D-valyl-D-prolyl-L-ornithyl-D-alloisoleucyl-D-allothreonyl-D-alloisoleucyl-D-valyl-L-phenylalanyl-(2Z)-2-amino-2-butenoyl-, (13→8)-lactone |
| CAS No. | 681272-30-0 |
Synthetic Route by SureRoute
2. ACANFV357 Molecular Building Block Synthetic Route
Muscotoxin A
(4R)-N-[(2E,4E,6E,8E,10E)-12-[(2-Hydroxy-5-oxo-1-cyclopenten-1-yl)amino]-1,12-dioxo-2,4,6,8,10-dodecapentaen-1-yl]-L-phenylalanyl-L-seryl-L-prolyl-L-proline, (6→2)-lactone
(3S,6S,9S,12S,15R,18S,21S,24S,29aS)-21,24-Dibenzyl-3,15-di((R)-sec-butyl)-12-(2-hydroxypropan-2-yl)-9-isobutyl-6,18-diisopropyl-5,11,17,23-tetramethyloctadecahydro-1H,15H-pyrrolo[1,2-m][1]oxa[4,7,10,13,16,19,22,25]octaazacycloheptacosine-1,4,7,10,13,16,19,22,25-nonaone