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Valilactone

Valilactone structure

CAS No:
113276-96-3
Formula:
C22H39NO5
Chemical Name:
Valilactone
Synonyms:
L-Valine,N-formyl-,(1S)-1-[[(2S,3S)-3-hexyl-4-oxo-2-oxetanyl]methyl]hexyl ester;L-Valine,N-formyl-,1-[(3-hexyl-4-oxo-2-oxetanyl)methyl]hexyl ester,[2S-[2α(R*),3β]]-;Valilactone;(-)-Valilactone

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Valilactone Basic Attributes

Molecular Weight：

397.5 g/mol

Exact Mass：

397.55

Characteristics

PSA：

81.7 Å²

Melting Point：

57-58 °C @ Solvent: Methanol, Water

Drug Information

MeSH Entry Terms：

5-(N-formyl-L-valinyloxy)-2-hexyl-3-hydroxydecanoic lactone

Computed Properties

Molecular Weight:397.5
XLogP3:6.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:16
Exact Mass:397.28282334
Monoisotopic Mass:397.28282334
Topological Polar Surface Area:81.7
Heavy Atom Count:28
Complexity:480
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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valilactone

CAS No.: 113276-96-3

Content: 99.00%

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Guide of Valilactone

Basic Attributes
Characteristics
Drug Information
Computed Properties
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