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Chemical structure of LMP744 (MJ-III65)

GC33389

LMP744 (MJ-III65)

Also known as 20-[3-(2-hydroxyethylamino)propyl]-15,16-dimethoxy-5,7-dioxa-20-azapentacyclo[10.8.0.02,10.04,8.013,18]icosa-1(12),2,4(8),9,13,15,17-heptaene-11,19-dione

LMP744 (MJ-III65) (MJ-III65) is a DNA intercalator and Topoisomerase I (Top1) inhibitor with antitumor activity

ChemicalCAS308246-52-8MW452.46FormulaC24H24N2O7
CAS number
308246-52-8
Molecular weight
452.46
Formula
C24H24N2O7
Solubility
Soluble in DMSO
InChIKey
QCSDJDQOJBQTDV-UHFFFAOYSA-N
Catalogue number
GC33389
Brand
GLPBIO
Computed properties PubChem CID 397888 · XLogP 1.4 · TPSA 107 Ų · H-bond donors 2
XLogP
1.4
TPSA
107 Ų
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
33

SMILES COC1=C(C=C2C(=C1)C3=C(C4=CC5=C(C=C4C3=O)OCO5)N(C2=O)CCCNCCO)OC

Computed descriptors from PubChem (CID 397888), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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