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PF-06380101 D8

  CAS No.:   Cat No.: BADC-01477 4.5  

PF-06380101 D8 (Aur0101 D8) is the deuterated version of PF-06380101. PF-06380101 is an Auristatin microtubule inhibitor, a cytotoxic Dolastatin 10 analogue.

PF-06380101 D8

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ADC Cytotoxin
Molecular Formula
C39H54D8N6O6S
Molecular Weight
751.06

* For research and manufacturing use only. We do not sell to patients.

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Synonyms
Aur0101 D8; Auristatin-0101 D8; (2S)-2-[(2-amino-2-methylpropanoyl)amino]-2,3,4,4,4-pentadeuterio-N-[(3R,4S,5S)-3-methoxy-1-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-[[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]amino]propyl]pyrrolidin-1-yl]-5-methyl-1-oxoheptan-4-yl]-N-methyl-3-(trideuteriomethyl)butanamide
IUPAC Name
(2S)-2-[(2-amino-2-methylpropanoyl)amino]-2,3,4,4,4-pentadeuterio-N-[(3R,4S,5S)-3-methoxy-1-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-[[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]amino]propyl]pyrrolidin-1-yl]-5-methyl-1-oxoheptan-4-yl]-N-methyl-3-(trideuteriomethyl)butanamide
Canonical SMILES
CCC(C)C(C(CC(=O)N1CCCC1C(C(C)C(=O)NC(CC2=CC=CC=C2)C3=NC=CS3)OC)OC)N(C)C(=O)C(C(C)C)NC(=O)C(C)(C)N
InChI
InChI=1S/C39H62N6O6S/c1-11-25(4)33(44(8)37(48)32(24(2)3)43-38(49)39(6,7)40)30(50-9)23-31(46)45-20-15-18-29(45)34(51-10)26(5)35(47)42-28(36-41-19-21-52-36)22-27-16-13-12-14-17-27/h12-14,16-17,19,21,24-26,28-30,32-34H,11,15,18,20,22-23,40H2,1-10H3,(H,42,47)(H,43,49)/t25-,26+,28-,29-,30+,32-,33-,34+/m0/s1/i2D3,3D3,24D,32D
InChIKey
QAAFNSMAIAVCHE-XYTWECGASA-N

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Historical Records: Trastuzumab emtansine | PF-06380101 | Trastuzumab-MC-MMAE | Trastuzumab duocarmazine | PF-06380101 D8
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