Monomethylauristatin E Impurity 10

CAT: 1299-RM-M752010-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-M752010-01Size:10 mg

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CAS Number

133565-38-5

Synonyms

(2R,3R) -3- ((S) -1- (tert-butoxycarbonyl) pyrrolidin-2-yl) -3-hydroxy-2-methylpropanoic acid

Molecular Formula

C13H23NO5

Molecular Weight

273.33

Target Alternative Name

Monomethylauristatin

Chemical Information

(2R,3R)-3-((S)-1-(tert-Butoxycarbonyl)pyrrolidin-2-yl)-3-hydroxy-2-methylpropanoic acid

CAS Number	133565-38-5
PubChem CID	10659844
IUPAC Name	(2R,3R)-3-hydroxy-2-methyl-3-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]propanoic acid
Molecular Formula	C13H23NO5
Molecular Weight	273.33
XLogP	1.1
Topological Polar Surface Area	87.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	19
Formal Charge	0
Complexity	349

SMILES

C[C@H]([C@H]([C@@H]1CCCN1C(=O)OC(C)(C)C)O)C(=O)O

InChI

InChI=1S/C13H23NO5/c1-8(11(16)17)10(15)9-6-5-7-14(9)12(18)19-13(2,3)4/h8-10,15H,5-7H2,1-4H3,(H,16,17)/t8-,9+,10-/m1/s1

InChIKey

NIEWBEWCDFGNTM-KXUCPTDWSA-N

Chemical Structure

2D Structure

CAS: 133565-38-5

CID: 10659844

Formula: C13H23NO5

MW: 273.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	273.33
XLogP3	1.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	273.15762283
Monoisotopic Mass	273.15762283
Topological Polar Surface Area	87.1 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	349
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-M752013-01	Monomethylauristatin E Impurity 13
RM-M752011-01	Monomethylauristatin E Impurity 11
RM-M752002-01	Monomethylauristatin E Impurity 2
RM-M752008-01	Monomethylauristatin E Impurity 8
RM-M752006-01	Monomethylauristatin E Impurity 6
RM-M752012-01	Monomethylauristatin E Impurity 12
RM-M752009-01	Monomethylauristatin E Impurity 9
RM-M752007-01	Monomethylauristatin E Impurity 7
RM-M752005-01	Monomethylauristatin E Impurity 5
RM-M752004-01	Monomethylauristatin E Impurity 4

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A13955-10	MonoMethylauristatin F (MMAF) 10mg
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