Account MC-VC-PAB-Cyclohexanediamine-Thailanstatin A
- Catalog No. :
- ACNLQQ157
- CAS No. :
- 1609108-96-4
- Molecular Formula :
- C63H91N9O16
- Molecular Weight :
- 1230.47
IUPAC Name:(S,Z)-5-(((2R,3R,5S,6S)-6-((2E,4E)-5-((3R,4R,5R,7S)-7-(2-((4-((((4-((S)-N-((S)-1-amino-1-oxo-5-ureidopentan-2-yl)-2-(6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido)-3-methylbutanamido)benzyl)oxy)carbonyl)amino)cyclohexyl)amino)-2-oxoethyl)-4-hydroxy-1,6-dioxaspiro[2.5]octan-5-yl)-3-methylpenta-2,4-dien-1-yl)-2,5-dimethyltetrahydro-2H-pyran-3-yl)amino)-5-oxopent-3-en-2-yl acetate
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5mg98%$2037.00Login to see priceInquiryInquiry
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Product Information
| Product Name | MC-VC-PAB-Cyclohexanediamine-Thailanstatin A |
|---|---|
| IUPAC Name | (S,Z)-5-(((2R,3R,5S,6S)-6-((2E,4E)-5-((3R,4R,5R,7S)-7-(2-((4-((((4-((S)-N-((S)-1-amino-1-oxo-5-ureidopentan-2-yl)-2-(6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido)-3-methylbutanamido)benzyl)oxy)carbonyl)amino)cyclohexyl)amino)-2-oxoethyl)-4-hydroxy-1,6-dioxaspiro[2.5]octan-5-yl)-3-methylpenta-2,4-dien-1-yl)-2,5-dimethyltetrahydro-2H-pyran-3-yl)amino)-5-oxopent-3-en-2-yl acetate |
| Molecular Formula | C63H91N9O16 |
| Molecular Weight | 1230.47 |
| SMILES | CC(=O)O[C@@H](C)/C=C\C(=O)N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/[C@H]2O[C@H](CC(=O)NC3CCC(NC(=O)OCC4=CC=C(N(C(=O)[C@@H](NC(=O)CCCCCN5C(=O)C=CC5=O)C(C)C)[C@@H](CCCNC(N)=O)C(N)=O)C=C4)CC3)C[C@@]3(CO3)[C@@H]2O)O[C@@H]1C |
| InChI Key | VYMFVPKLPOTXIM-CCLVJESHSA-N |
| Synonym | MC-VC-PAB-Cyclohexanediamine-Thailanstatin A;L-Ornithinamide, N-[6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxohexyl]-L-valyl-N-[4-[[[[[trans-4-[[2-[(3R,5S,7R,8R)-7-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(2Z,4S)-4-(acetyloxy)-1-oxo-2-penten-1-yl]amino]tetrahydro-3,6-dimethyl-2H-pyran-2-yl]-3-methyl-1,3-pentadien-1-yl]-8-hydroxy-1,6-dioxaspiro[2.5]oct-5-yl]acetyl]amino]cyclohexyl]amino]carbonyl]oxy]methyl]phenyl]-N5-(aminocarbonyl)- |
| CAS No. | 1609108-96-4 |
