OCDCEA – octadecenoate (n-C18:1)
Name | ||
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WID | OCDCEA |
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Name | octadecenoate (n-C18:1) |
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Traditional name | octadec-9-enoate | |
IUPAC name | octadec-9-enoate | |
Cross references | ChEBI: 16196, PubChem: 4265936, KEGG: C00712, LipidBank: DFA0111, LIPIDMAPS: LMFA01030002, BiGG: ocdcea | |
Classification | ||
Type | fatty_acyl |
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Structure | ||
Empirical formula (pH 7.5) | H33C18O2 | |
SMILES (pH 7.5) | CCCCCCCCC=CCCCCCCCC([O-])=O | |
Charge (pH 7.5) | -1 | |
Is hydrophobic | False |
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Molecular weight (Da) | 281.45 |
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van der Waals volume (pH 7.5; Å3 molecule‑1) |
317.63 | |
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) | 1258.20 | |
logP | 6.78 | |
logD (pH 7.5) | 4.59 | |
Concentrations | ||
Media composition (SP4; mM) | 0.320 |
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Function | ||
Complex subunit | cis-octadec-11-enoyl-[acyl-carrier protein] (n-C18:1) [c]: ATP + COA + MG_287_MONOMER + OCDCEA ⇒ AMP + H + PAP + PPI + MG_287_MONOMER_octeACP |
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Reaction participant |
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Comments | ||
Comments | SP4 media composition calculations estimated SP4 media contains 18.5 mg OCDCA / L. However the simulation suggests additional OCDCA is required for growth. Concentration set to 90 mg / L to support growth. | |
Metadata | ||
Created | 2012-10-01 15:07:05 | |
Last updated | 2012-10-01 15:12:26 |