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ixabepilone

CHEBI:CHEBI_63605

Definition

A macrocycle that is a lactam analogue of epothilone B. Binds directly to beta-tubulin subunits on microtubules, leading to suppression of microtubule dynamics.

Chemical Information

Molecular Formula
C27H42N2O5S
Molecular Mass
506.69800
Charge
0
SMILES
[H][C@]12C[C@H](NC(=O)C[C@H](O)C(C)(C)C(=O)[C@H](C)[C@@H](O)[C@@H](C)CCC[C@@]1(C)O2)C(\C)=C\c1csc(C)n1
InChI
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
InChIKey
FABUFPQFXZVHFB-PVYNADRNSA-N

Alternative Names

  • Aza-epothilone B
  • Azaepothilone B
  • BMS-247550
  • ixabepilone

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
337523
oboInOwl#hasDbXref
Wikipedia:Ixabepilone
core#notation
CHEBI:63605

Additional References

Wikipedia:Ixabepilone

🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.

Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
337523
oboInOwl#hasDbXref
Wikipedia:Ixabepilone
oboInOwl#id
CHEBI:63605
core#notation
CHEBI:63605
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_61951
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
rdf-schema#domain
https://w3id.org/def/predibionto#has_side_effect30501
owl#annotatedSource
t262948
owl#someValuesFrom
t2915598