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Chemical structure of Tubulysin A

GC33155

Tubulysin A

Also listed as Tubulysin A (TubA)

Tubulysin A (TubA)(TubA) is a myxobacterial product that can function as an antiangiogenic agent in many in vitro assays; anti-microtubule, anti-mitotic, an apoptosis inducer, anticancer, anti-angiogenic, and antiproliferative

ChemicalCAS205304-86-5MW844.07FormulaC43H65N5O10S
CAS number
205304-86-5
Molecular weight
844.07
Formula
C43H65N5O10S
Solubility
Soluble in DMSO
InChIKey
IBEDDHUHZBDXGB-OEJISELMSA-N
Catalogue number
GC33155
Brand
GLPBIO
Computed properties PubChem CID 12134544 · XLogP 4.7 · TPSA 233 Ų · H-bond donors 4
XLogP
4.7
TPSA
233 Ų
H-bond donors
4
H-bond acceptors
13
Rotatable bonds
24
Heavy atoms
59

SMILES CC[C@H](C)[C@@H](C(=O)N(COC(=O)CC(C)C)[C@H](C[C@H](C1=NC(=CS1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C[C@H](C)C(=O)O)OC(=O)C)C(C)C)NC(=O)[C@H]3CCCCN3C

Computed descriptors from PubChem (CID 12134544), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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