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Chemical structure of GalNac-L96

GC69147

GalNac-L96

Also known as 4-[(3R,5S)-1-[12-[[1,3-bis[3-[3-[5-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]-2-[[3-[3-[5-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]propan-2-yl]amino]-12-oxododecanoyl]-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]pyrrolidin-3-yl]oxy-4-oxobutanoic acid;N,N-diethylethanamine

GalNac-L96 is a oligonucleotide rich in G and has a long GalNAc linker, which can be used for delivering nucleic acid drugs

ChemicalCAS1159408-62-4MW2608.95FormulaC127H194N12O45
CAS number
1159408-62-4
Molecular weight
2608.95
Formula
C127H194N12O45
Solubility
DMSO : 125 mg/mL (47·91 mM; Need ultrasonic)
InChIKey
IJXFTQRCIYIYHZ-MCDRDKEWSA-N
Catalogue number
GC69147
Brand
GLPBIO
Computed properties PubChem CID 168006875 · TPSA 726 Ų · H-bond donors 11 · H-bond acceptors 46
TPSA
726 Ų
H-bond donors
11
H-bond acceptors
46
Rotatable bonds
97
Heavy atoms
184

SMILES CCN(CC)CC.CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1OCCCCC(=O)NCCCNC(=O)CCOCC(COCCC(=O)NCCCNC(=O)CCCCO[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)(COCCC(=O)NCCCNC(=O)CCCCO[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)NC(=O)CCCCCCCCCCC(=O)N4C[C@@H](C[C@H]4COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)OC(=O)CCC(=O)O)COC(=O)C)OC(=O)C)OC(=O)C

Computed descriptors from PubChem (CID 168006875), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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