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Chemical structure of PNU-159682 carboxylic acid

GC66071

PNU-159682 carboxylic acid

Also known as (2S,4S)-2,5,12-trihydroxy-7-methoxy-4-[[(2S,4R,6S,7S,9R,10S)-10-methoxy-6-methyl-5,8,11-trioxa-1-azatricyclo[7.4.0.02,7]tridecan-4-yl]oxy]-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid

PNU-159682 carboxylic acid (compound 53) is a potent ADCs cytotoxin and encodes a member of the C-type lectin/C-type lectin-like domain (CTL/CTLD) superfamily· PNU-159682 carboxylic acid has protein fold and diverse functions, such as cell adhesion, cell-cell signalling, glycoprotein turnover, and roles in inflammation and immune response

ChemicalCAS1204819-92-0MW627.59FormulaC31H33NO13
CAS number
1204819-92-0
Molecular weight
627.59
Formula
C31H33NO13
Solubility
DMSO : 50 mg/mL (79·67 mM; Need ultrasonic)
InChIKey
QRJDFOACHALIRS-LURYFDOKSA-N
Catalogue number
GC66071
Brand
GLPBIO
Computed properties PubChem CID 59184937 · XLogP 0 · TPSA 191 Ų · H-bond donors 4
XLogP
0
TPSA
191 Ų
H-bond donors
4
H-bond acceptors
14
Rotatable bonds
5
Heavy atoms
45

SMILES C[C@H]1[C@@H]2[C@H](C[C@@H](O1)O[C@H]3C[C@@](CC4=C3C(=C5C(=C4O)C(=O)C6=C(C5=O)C(=CC=C6)OC)O)(C(=O)O)O)N7CCO[C@@H]([C@H]7O2)OC

Computed descriptors from PubChem (CID 59184937), 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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