Account Thailanstatin C
- Catalog No. :
- ACPEBO233
- CAS No. :
- 1426953-24-3
- Molecular Formula :
- C30H46ClNO9
- Molecular Weight :
- 600.15
IUPAC Name:2-((2S,4S,5R,6R)-4-(chloromethyl)-4,5-dihydroxy-6-((1E,3E)-5-((2S,3S,5R,6R)-5-((S,Z)-4-(isobutyryloxy)pent-2-enamido)-3,6-dimethyltetrahydro-2H-pyran-2-yl)-3-methylpenta-1,3-dien-1-yl)tetrahydro-2H-pyran-2-yl)acetic acid
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Product Information
| Product Name | Thailanstatin C |
|---|---|
| IUPAC Name | 2-((2S,4S,5R,6R)-4-(chloromethyl)-4,5-dihydroxy-6-((1E,3E)-5-((2S,3S,5R,6R)-5-((S,Z)-4-(isobutyryloxy)pent-2-enamido)-3,6-dimethyltetrahydro-2H-pyran-2-yl)-3-methylpenta-1,3-dien-1-yl)tetrahydro-2H-pyran-2-yl)acetic acid |
| Molecular Formula | C30H46ClNO9 |
| Molecular Weight | 600.15 |
| SMILES | C(=C/C(=C/C[C@H]1[C@@H](C)C[C@@H](NC(/C=C\[C@@H](OC(C(C)C)=O)C)=O)[C@@H](C)O1)/C)\[C@@H]2[C@@H](O)[C@@](CCl)(O)C[C@@H](CC(O)=O)O2 |
| InChI Key | IUEAQIHFZAHMMU-WEDQMBCXSA-N |
| Synonym | Thailanstatin C;2H-Pyran-2-acetic acid, 4-(chloromethyl)tetrahydro-4,5-dihydroxy-6-[(1E,3E)-3-methyl-5-[(2S,3S,5R,6R)-tetrahydro-3,6-dimethyl-5-[[(2Z,4S)-4-(2-methyl-1-oxopropoxy)-1-oxo-2-penten-1-yl]amino]-2H-pyran-2-yl]-1,3-pentadien-1-yl]-, (2S,4S,5R,6R)-;2-[(2S,4S,5R,6R)-4-(chloromethyl)-6-[(1E,3E)-5-[(2S,3S,5R,6R)-3,6-dimethyl-5-[(2Z,4S)-4-[(2-methylpropanoyl)oxy]pent-2-enamido]oxan-2-yl]-3-methylpenta-1,3-dien-1-yl]-4,5-dihydroxyoxan-2-yl]acetic acid |
| CAS No. | 1426953-24-3 |
Synthetic Route by SureRoute
2. ACPEBO233 Molecular Building Block Synthetic Route
2-((3R,5S,7R,8R)-7-((1E,3E)-5-((2S,3S,5R,6R)-5-((S,Z)-4-Acetoxypent-2-enamido)-3,6-dimethyltetrahydro-2H-pyran-2-yl)-3-methylpenta-1,3-dien-1-yl)-8-hydroxy-1,6-dioxaspiro[2.5]octan-5-yl)acetic acid
FR901463
(S,Z)-5-(((2R,3R,5S,6S)-6-((2E,4E)-5-((3R,4R,5R)-4-Hydroxy-7,7-dimethyl-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