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Chemical structure of DCG04

GB62244

DCG04

Also known as ethyl 3-[[(2S)-1-[[(2S)-1-[[6-[[(2S)-1-amino-1-oxo-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexan-2-yl]amino]-6-oxohexyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylate

DCG04 is a multivalent ligand for the mannose-6-phosphate receptor for endolysosomal targeting of an activity-based probe

ChemicalCAS314263-42-8MW903.106FormulaC43H66N8O11S
CAS number
314263-42-8
Molecular weight
903.106
Formula
C43H66N8O11S
Solubility
Soluble in DMSO
InChIKey
MHOVYDVXSWUHAZ-NNBHGYTGSA-N
Catalogue number
GB62244
Brand
GLPBIO
Computed properties PubChem CID 71296083 · XLogP 1.8 · TPSA 314 Ų · H-bond donors 9
XLogP
1.8
TPSA
314 Ų
H-bond donors
9
H-bond acceptors
12
Rotatable bonds
30
Heavy atoms
63

SMILES CCOC(=O)C1C(O1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)NCCCCCC(=O)N[C@@H](CCCCNC(=O)CCCCC3C4C(CS3)NC(=O)N4)C(=O)N

Computed descriptors from PubChem (CID 71296083), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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