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Chemical structure of Mc-Alanyl-Alanyl-Asparagine-PAB-MMAE

GC65552

Mc-Alanyl-Alanyl-Asparagine-PAB-MMAE

Also known as [4-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[6-(2,5-dioxopyrrol-1-yl)hexanoylamino]propanoyl]amino]propanoyl]amino]-4-oxobutanoyl]amino]phenyl]methyl N-[(2S)-1-[[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylcarbamate

Mc-Alanyl-Alanyl-Asparagine-PAB-MMAE (compound S6) is a potent anticancer agent, which can be specific activated by tumor microenvironment· Mc-Alanyl-Alanyl-Asparagine-PAB-MMAE can suppress tumor growth in mice (extracted from patent CN104147612A)

ChemicalCAS1638970-46-3MW1316.58FormulaC67H101N11O16
CAS number
1638970-46-3
Molecular weight
1316.58
Formula
C67H101N11O16
Solubility
DMSO : 180 mg/mL (136·72 mM; Need ultrasonic)
InChIKey
AWJDDTWUHNATEN-NAMAUAOVSA-N
Catalogue number
GC65552
Brand
GLPBIO
Computed properties PubChem CID 164886611 · XLogP 3.1 · TPSA 364 Ų · H-bond donors 8
XLogP
3.1
TPSA
364 Ų
H-bond donors
8
H-bond acceptors
16
Rotatable bonds
38
Heavy atoms
94

SMILES CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@H](C)[C@H](C2=CC=CC=C2)O)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)OCC3=CC=C(C=C3)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CCCCCN4C(=O)C=CC4=O

Computed descriptors from PubChem (CID 164886611), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.