 Home > Encyclopedia > L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R*,R*)]- (9CI)

L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R,R)]- (9CI)

L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R*,R*)]- (9CI) structure

CAS No:
126380-04-9
Formula:
C37H60N6O12
Chemical Name:
L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R*,R*)]- (9CI)

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L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R,R)]- (9CI) Basic Attributes

Molecular Weight：

780.90500

Exact Mass：

780.42692137

DSSTox ID：

DTXSID50155170

Characteristics

PSA：

291.76000

XLogP3：

4.31610

Density：

1.213g/cm3

Boiling Point：

1105.9ºC

Flash Point：

622.6ºC

Refractive Index：

1.534

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:780.9
XLogP3:1.8
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:23
Exact Mass:780.42692137
Monoisotopic Mass:780.42692137
Topological Polar Surface Area:271
Heavy Atom Count:55
Complexity:1300
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R*,R*)]- (9CI)

Basic Attributes
Characteristics
Computed Properties
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L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R*,R*)]- (9CI)

L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R*,R*)]- (9CI) Basic Attributes

Characteristics

Computed Properties

L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R,R)]- (9CI)

L-Valine,N-[N-[5-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-4-hydroxy-6-(4-hydroxyphenyl)-1-oxohexyl]-L-valyl]-,methyl ester, [S-(R,R)]- (9CI) Basic Attributes