CAS
97781-16-3 Purity
98 atom % D
97781-16-3 Purity
98 atom % D
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L-Leucinamide,N-[(phenylmethoxy)carbonyl]glycylglycyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-
CAS
97792-39-7
Catalog Number
ACM97792397
Category
Other Products
Molecular Weight
536.58
Molecular Formula
C28H32N4O7
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Specification
Synonyms
PROTEASOME SUBSTRATE V, FLUOROGENIC;Z-GLY-GLY-LEU-AMC;Z-GGL-AMC;7-(N-benzyloxycarbonylglycyl-glycyl-leucyl)amino-4-methylcoumarin
IUPAC Name
benzyl N-[2-[[2-[[3-methyl-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]carbamate
Canonical SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CC(C)C)NC(=O)CNC(=O)CNC(=O)OCC3=CC=CC=C3
InChI Key
JEGGCCQOBMCUKZ-UHFFFAOYSA-N
Boiling Point
877.6ºC at 760 mmHg
Flash Point
484.6ºC
Density
1.281g/cm³
Exact Mass
536.22700
H-Bond Acceptor
7
H-Bond Donor
4
What is the molecular formula of L-Leucinamide,N-[(phenylmethoxy)carbonyl]glycylglycyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)?
The molecular formula is C28H32N4O7.
When was the compound created and last modified?
The compound was created on March 24, 2008, and last modified on December 30, 2023.
What is the IUPAC name of the compound?
The IUPAC name is benzyl N-[2-[[2-[[(2S)-4-methyl-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]carbamate.
What is the InChIKey of the compound?
The InChIKey is WWRUTMQQQWGCPG-QFIPXVFZSA-N.
What is the molecular weight of the compound?
The molecular weight is 536.6 g/mol.
How many hydrogen bond donor counts does the compound have?
The compound has 4 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 2.7.
What is the topological polar surface area of the compound?
The topological polar surface area is 152 Ų.
How many defined atom stereocenter counts does the compound have?
The compound has 1 defined atom stereocenter count.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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