Name: Name:(2S)-2-(cyclohexylformamido)propanoic acid
Brand: Angene
SKU: AG019WGO
Rating: 90 (10 reviews)

(2S)-2-(cyclohexylformamido)propanoic acid

CAS No.:

180991-54-2

Catalog Number:

AG019WGO

Molecular Formula:

C10H17NO3

Molecular Weight:

199.2469

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Product Description

Catalog Number:

AG019WGO

Chemical Name:

(2S)-2-(cyclohexylformamido)propanoic acid

CAS Number:

180991-54-2

Molecular Formula:

C10H17NO3

Molecular Weight:

199.2469

MDL Number:

MFCD12913033

IUPAC Name:

(2S)-2-(cyclohexanecarbonylamino)propanoic acid

InChI:

InChI=1S/C10H17NO3/c1-7(10(13)14)11-9(12)8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,11,12)(H,13,14)/t7-/m0/s1

InChI Key:

LYBZCFYXVCCLLS-ZETCQYMHSA-N

SMILES:

C[C@@H](C(=O)O)NC(=O)C1CCCCC1

Properties

Complexity:

221

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

199.25g/mol

Monoisotopic Mass:

199.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Trierixin, a novel Inhibitor of ER stress-induced XBP1 activation from Streptomyces sp. II. structure elucidation.	The Journal of antibiotics 20070901