Account Apratoxin A
- Catalog No. :
- ACWINH495
- CAS No. :
- 350791-64-9
- Molecular Formula :
- C45H69N5O8S
- Molecular Weight :
- 840.14
IUPAC Name:Apratoxin A
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Product Information
| Product Name | Apratoxin A |
|---|---|
| IUPAC Name | Apratoxin A |
| Molecular Formula | C45H69N5O8S |
| Molecular Weight | 840.14 |
| SMILES | O=C1N2[C@](CCC2)([H])C(O[C@@H](C[C@H](C[C@@H]([C@@H](C3=N[C@](/C=C(C(N[C@H](C(N([C@H](C(N([C@@]1([H])[C@@H](C)CC)C)=O)C)C)=O)CC4=CC=C(C=C4)OC)=O)\C)([H])CS3)C)O)C)C(C)(C)C)=O |
| InChI Key | KXUJXPZXILTXDA-CKIYSKEDSA-N |
| Synonym | Apratoxin A;L-Proline, N-[(2E)-3-[(4S)-2-[(1S,2S,4S,6S)-2,6-dihydroxy-1,4,7,7-tetramethyloctyl]-4,5-dihydro-4-thiazolyl]-2-methyl-1-oxo-2-propen-1-yl]-O-methyl-L-tyrosyl-N-methyl-L-alanyl-N-methyl-L-isoleucyl-, (4→16)-lactone |
| CAS No. | 350791-64-9 |
Synthetic Route by SureRoute
2. ACWINH495 Molecular Building Block Synthetic Route
Apratoxin S4
(S)-N-((R)-1-(((3S,6R,7S,10R,11S,15S,17S,20S,25aS)-10-((S)-sec-butyl)-11-hydroxy-20-isobutyl-15-isopropyl-3-(4-methoxybenzyl)-2,6,17-trimethyl-1,4,8,13,16,18,21-heptaoxodocosahydro-15H-pyrrolo[2,1-f][1,15]dioxa[4,7,10,20]tetraazacyclotricosin-7-yl)amino)-
(S)-N-((R)-1-(((3S,6R,7S,10R,11S,15S,17S,20S,25aS)-10-((S)-sec-butyl)-11-hydroxy-20-isobutyl-15-isopropyl-3-(4-methoxybenzyl)-2,6,17-trimethyl-1,4,8,13,16,18,21-heptaoxodocosahydro-15H-pyrrolo[2,1-f][1,15]dioxa[4,7,10,20]tetraazacyclotricosin-7-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((S)-2-hydroxypropanoyl)-N-methylpyrrolidine-2-carboxamide