Ixabepilone

• CAS: 219989-84-1
• Catalog Number: ACM219989841
• Category: Inhibitors
• Molecular Weight: 506.7
• Molecular Formula: C₂₇H₄₂N₂O₅S
• Description: Ixabepilone (BMS-247550) is an orally bioavailable microtubule inhibitor, which binds to tubulin and promotes tubulin polymerization and microtubule stabilization, thereby arrests cells in the G2-M phase of the cell cycle and induces tumor cell apoptosis.
• Synonyms: IXABEPILONE;(1R,5S,6S,7R,10S,14S,16S)-6,10-dihydroxy-1,5,7,9,9-pentamethyl-14-[(E) -1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-17-oxa-13-azabicyclo[14. 1.0]heptadecane-8,12-dione;Aza-epothilone B;Bms 247550-1;Ixempra;Ixempra kit;Unii-K27005np0a;Azi-epothilone B
• Canonical SMILES: O=C([C@@H]([C@H]([C@H](CCC[C@]1(O[C@]1(C[C@H](N2)/C(C)=C/C3=CSC(C)=N3)[H])C)C)O)C)C(C)([C@H](CC2=O)O)C
• Appearance: Solid
• Storage: 4°C, protect from light*In solvent : -80°C, 6 months; -20°C, 1 month (protect from light).
• Shipping: Can be shipped at room temperature, where not in use may vary.

Custom Q&A

What is the PubChem CID of Ixabepilone?

PubChem CID of Ixabepilone is 6445540.

What is the molecular formula of Ixabepilone?

The molecular formula of Ixabepilone is C27H42N2O5S.

What is the molecular weight of Ixabepilone?

The molecular weight of Ixabepilone is 506.7 g/mol.

What is the IUPAC name of Ixabepilone?

The IUPAC name of Ixabepilone is (1S,3S,7S,10R,11S,12S,16R)-7,11-dihydroxy-8,8,10,12,16-pentamethyl-3-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-17-oxa-4-azabicyclo[14.1.0]heptadecane-5,9-dione.

What is the InChI of Ixabepilone?

The InChI of Ixabepilone is InChI=1S/C27H42N2O5S/c1-15-9-8-10-27(7)22(34-27)12-20(16(2)11-19-14-35-18(4)28-19)29-23(31)13-21(30)26(5,6)25(33)17(3)24(15)32/h11,14-15,17,20-22,24,30,32H,8-10,12-13H2,1-7H3,(H,29,31)/b16-11+/t15-,17+,20-,21-,22-,24-,27+/m0/s1.

What is the InChIKey of Ixabepilone?

The InChIKey of Ixabepilone is FABUFPQFXZVHFB-PVYNADRNSA-N.

What is the canonical SMILES of Ixabepilone?

The canonical SMILES of Ixabepilone is CC1CCCC2(C(O2)CC(NC(=O)CC(C(C(=O)C(C1O)C)(C)C)O)C(=CC3=CSC(=N3)C)C)C.

What is the CAS number of Ixabepilone?

The CAS number of Ixabepilone is 219989-84-1.

What is the trade name of Ixabepilone?

The trade name of Ixabepilone is Ixempra.

What is the pharmacological effect of Ixabepilone?

The pharmacological effect of Ixabepilone is Microtubule Inhibition.