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Chemical structure of Epothilone B

GC17240

Epothilone B

Also listed as Epothilone B (EPO906, Patupilone)

Epothilone B (EPO906, Patupilone) is a microtubule stabilizer with a Ki of 0·71μM

ChemicalCAS152044-54-7MW507.68FormulaC27H41NO6S
CAS number
152044-54-7
Molecular weight
507.68
Formula
C27H41NO6S
Solubility
≥ 25·4mg/mL in DMSO
InChIKey
QXRSDHAAWVKZLJ-PVYNADRNSA-N
Catalogue number
GC17240
Brand
GLPBIO
Computed properties PubChem CID 448013 · XLogP 4.2 · TPSA 137 Ų · H-bond donors 2
XLogP
4.2
TPSA
137 Ų
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
2
Heavy atoms
35

SMILES C[C@H]1CCC[C@@]2([C@@H](O2)C[C@H](OC(=O)C[C@@H](C(C(=O)[C@@H]([C@H]1O)C)(C)C)O)/C(=C/C3=CSC(=N3)C)/C)C

Computed descriptors from PubChem (CID 448013), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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