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Structure

L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)

CAS
93936-27-7
Catalog Number
ACM93936277
Category
Other Products
Molecular Weight
383.44
Molecular Formula
C21H25N3O4

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What is the molecular formula of L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

The molecular formula is C21H25N3O4.

What is the PubChem CID number for L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

The PubChem CID number is 7019923.

What is the IUPAC name of L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

The IUPAC name is (2S)-2-[[(2S)-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanamide.

What is the InChI of L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

The InChI is InChI=1S/C21H25N3O4/c1-14(2)19(20(22)26)24-21(27)17(13-15-7-4-3-5-8-15)23-18(25)11-10-16-9-6-12-28-16/h3-12,14,17,19H,13H2,1-2H3,(H2,22,26)(H,23,25)(H,24,27)/b11-10+/t17-,19-/m0/s1.

What is the molecular weight of L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

The molecular weight is 383.4 g/mol.

What is the XLogP3 value of L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

The XLogP3 value is 1.6.

How many hydrogen bond donor counts are there in L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

There are 3 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

There are 4 hydrogen bond acceptor counts.

How many rotatable bond counts are there in L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci)?

There are 9 rotatable bond counts.

Is L-Valinamide,N-[3-(2-furanyl)-1-oxo-2-propenyl]-L-phenylalanyl-(9ci) a canonicalized compound?

Yes, it is a canonicalized compound.

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