General Information of the Compound
| Compound ID |
CP0075153
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| Compound Name |
1-tridecanecarboxylic acid
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| Synonyms |
1-Tridecanecarboxylic acid
544-63-8
AI3-15381
C14 fatty acid
C14:0
CCRIS 4724
CH3-[CH2]12-COOH
CHEBI:28875
Crodacid
EINECS 208-875-2
Emery 655
FEMA No. 2764
HSDB 5686
Hydrofol acid 1495
Hystrene 9014
MYRISTIC ACID
Myristate
Myristic acid (natural)
Myristic acid, pure
Myristinsaeure
NSC 5028
Neo-fat 14
Philacid 1400
Prifac 2942
Tetradecanoate
Tetradecanoic acid
UNII-0I3V7S25AW
Univol U 316S
acide tetradecanoique
n-Myristic acid
n-Tetradecan-1-oic acid
n-Tetradecanoic acid
n-Tetradecoic acid
tetradecoic acid
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| Structure |
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| Formula |
C14H28O2
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| Molecular Weight |
228.376
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| Canonical SMILES |
CCCCCCCCCCCCCC(O)=O
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| InChI |
InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)
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| InChIKey |
TUNFSRHWOTWDNC-UHFFFAOYSA-N
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| CAS |
45184-05-2
32112-52-0
544-63-8
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04383, G-protein coupled receptor 84
Protein ID: PT06109, Geminin
Protein ID: PT00910, Peroxisome proliferator-activated receptor alpha
Clinical Information about the Compound
Drug 1 ( MYRISTIC ACID )
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