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[2-hydroxy-3-(octadeca-9,12-dienoyloxy)propoxy]phosphonic acid
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ChemBase ID:
133713
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Molecular Formular:
C21H39O7P
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Molecular Mass:
434.503921
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Monoisotopic Mass:
434.24334022
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SMILES and InChIs
SMILES:
CCCCC/C=C/C/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)O)O
Canonical SMILES:
CCCCC/C=C/C/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)O)O
InChI:
InChI=1S/C21H39O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h6-7,9-10,20,22H,2-5,8,11-19H2,1H3,(H2,24,25,26)/b7-6+,10-9+
InChIKey:
ZQTAMPRZFOOEEP-AVQMFFATSA-N
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Cite this record
CBID:133713 http://www.chembase.cn/molecule-133713.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
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IUPAC name
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[2-hydroxy-3-(octadeca-9,12-dienoyloxy)propoxy]phosphonic acid
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{2-hydroxy-3-[(9E,12E)-octadeca-9,12-dienoyloxy]propoxy}phosphonic acid
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IUPAC Traditional name
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2-hydroxy-3-(octadeca-9,12-dienoyloxy)propoxyphosphonic acid
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2-hydroxy-3-[(9E,12E)-octadeca-9,12-dienoyloxy]propoxyphosphonic acid
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Synonyms
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Anti-Platelet-activating factor acetylhydrolase
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Anti-Lissencephaly 1
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Anti-PAFAH
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Anti-LIS1 antibody produced in rabbit
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Monoclonal Anti-LIS1 antibody produced in mouse
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MDL Number
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PubChem SID
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PubChem CID
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NCBI accession number
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
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Acid pKa
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1.5053178
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H Acceptors
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5
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H Donor
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3
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LogD (pH = 5.5)
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2.7191758
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LogD (pH = 7.4)
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1.8368158
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Log P
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5.123768
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Molar Refractivity
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116.4156 cm3
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Polarizability
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45.21914 Å3
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Polar Surface Area
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113.29 Å2
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Rotatable Bonds
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20
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Lipinski's Rule of Five
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false
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DETAILS
DETAILS
Sigma Aldrich
Sigma Aldrich -
SAB3500302
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Immunogen LIS1 antibody was raised against a 14 amino acid peptide from near the carboxy terminus of human LIS1. Physical form Supplied in PBS with 0.02% sodium azide. |
Sigma Aldrich -
L7391
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Immunogen recombinant human LIS1 protein. Specificity By immunoblotting, the antibody prefers the phosphorylated form of the LIS1 molecule (46 kDa). Physical form Solution in 0.01 M phosphate buffered saline, pH 7.4, containing 15 mM sodium azide. |
PATENTS
PATENTS
PubChem Patent
Google Patent