ChemicalBook--->CAS DataBase List--->160800-57-7

160800-57-7

160800-57-7 Structure

160800-57-7 Structure
IdentificationBack Directory
[Name]

Auristatin E
[CAS]

160800-57-7
[Synonyms]

Auristatin E
L-Valinamide, N,N-dimethyl-L-valyl-N-[(1S,2R)-4-[(2S)-2-[(1R,2R)-3-[[(1R,2S)-2-hydroxy-1-methyl-2-phenylethyl]amino]-1-methoxy-2-methyl-3-oxopropyl]-1-pyrrolidinyl]-2-methoxy-1-[(1S)-1-methylpropyl]-4-oxobutyl]-N-methyl-
[Molecular Formula]

C40H69N5O7
[MDL Number]

MFCD25976744
[MOL File]

160800-57-7.mol
[Molecular Weight]

732.01
Chemical PropertiesBack Directory
[Melting point ]

92-94 °C
[Boiling point ]

871.0±65.0 °C(Predicted)
[density ]

1.085±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C,unstable in solution, ready to use.
[solubility ]

Soluble in DMSO
[form ]

Solid
[pka]

13.66±0.20(Predicted)
[color ]

White to light yellow
[InChIKey]

MOBSAMWSCWMKOB-FEFUEGSOSA-N
[SMILES]

C(NC(=O)[C@H](C(C)C)N(C)C)(=O)[C@H](C(C)C)N([C@@H]([C@@H](C)CC)[C@H](OC)CC(N1CCC[C@H]1[C@H](OC)[C@@H](C)C(N[C@H](C)[C@@H](O)C1=CC=CC=C1)=O)=O)C
Safety DataBack Directory
[Symbol(GHS) ]

Health Hazard (GHS08)
GHS08
[Signal word ]

Danger
[Hazard statements ]

H341-H361-H372
[Precautionary statements ]

P201-P202-P281-P308+P313-P405-P501-P201-P202-P281-P308+P313-P405-P501-P260-P264-P270-P314-P501
Hazard InformationBack Directory
[Description]

Auristatin E is a cytotoxic tubulin modifier with potent and selective antitumor activity; it is a synthetic analog of dolastatin 10. Auristatin E is a highly potent antimitotic agent. Auristatin E inhibits tubulin polymerization(1). Auristatin E-antibody cunjugates have proven to be successful anticancer agents.(2)
Ref. 1. Pettit et al. Anticancer Drug Des. 1995 10:529.
Ref. 2. Doronina et al. Nature Biotechnol. 2003 21:778.
[Uses]

Auristatin E (GMP) is Auristatin E (HY-15582) produced by using GMP guidelines. Auristatin E is a tubulin polymerization inhibitor[1].
[storage]

Store at -20°C,unstable in solution, ready to use.
[References]

[1] Francisco JA, et al. cAC10-vcMMAE, an anti-CD30-monomethyl auristatin E conjugate with potent and selective antitumor activity. Blood. 2003 Aug 15;102(4):1458-65. DOI:10.1182/blood-2003-01-0039
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