D8-MMAE

cas: 2070009-72-0 — see every product listed under this CAS number, including other names

D8-MMAE (CAS 2070009-72-0) is a chemical reagent available from Chemat. Available pack sizes: 2mg, 1mg, 5mg. Offered by: Biosynth.

brandBiosynth
catalog numberVHD00972-2mg
cas2070009-72-0
size2mg
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properties

categoryLife Sciences
sub-category 1Ligands
purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

(2S)-2,3,4,4,4-pentadeuterio-N-[(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]-N-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-3-(trideuteriomethyl)butanamide (CAS 2070009-72-0) is a chemical compound with the molecular formula C39H67N5O7 and a molecular weight of 726.0 g/mol. IUPAC name: (2S)-2,3,4,4,4-pentadeuterio-N-[(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]-N-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-3-(trideuteriomethyl)butanamide. InChIKey: DASWEROEPLKSEI-CMHCZSPYSA-N.

Identity
Molecular formulaC39H67N5O7
Molecular weight726.0 g/mol
IUPAC name(2S)-2,3,4,4,4-pentadeuterio-N-[(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]-N-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-3-(trideuteriomethyl)butanamide
InChIKeyDASWEROEPLKSEI-CMHCZSPYSA-N
SMILES[2H][C@@](C(=O)N(C)[C@@H]([C@@H](C)CC)[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)(C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])NC(=O)[C@H](C(C)C)NC

Computed by PubChem (NCBI)

Synonyms: MMAE-d8, Monomethylauristatin E-d8, orb1709934, Monomethyl auristatin E-d8;Deuterated labeled MMAE
Related forms of this compound
(2S)-N-[(2S)-1-[[(3R,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]-3-methyl-2-(methylamino)butanamide C39H67N5O7
(2S)-N-[(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]-3-methyl-2-(methylamino)butanamide C39H67N5O7

Also listed as

MMAE-d8 TargetMol CAS 2070009-72-0
MMAE–d8 GLPBio CAS 2070009-72-0
MMAE-d8, 99.29% MedChemExpress CAS 2070009-72-0