Corchorifatty acid F

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Systematic / IUPAC Name: (10E,15Z)-9,12,13-Trihydroxyoctadeca-10,15-dienoic acid

ID: Reference7750

Other Names: (10E,15Z)-9,12,13-Trihydroxy-10,15-octadecadienoic acid;
9,12,13-Trihydroxy-10(E),15(Z)-octadecadienoic acid

Formula: C18H32O5

Spectral Data

Corchorifatty acid F mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 4/11/2018 7:45:29 AM
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Identificators

InChI InChI=1S/C18H32O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h3,7,13-17,19-21H,2,4-6,8-12H2,1H3,(H,22,23)/b7-3-,14-13+
InChI Key MKYUCBXUUSZMQB-MKZMYESJSA-N
Canonical SMILES CCC=CCC(C(C=CC(CCCCCCCC(=O)O)O)O)O
CAS
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Other Names (10E,15Z)-9,12,13-Trihydroxy-10,15-octadecadienoic acid;
9,12,13-Trihydroxy-10(E),15(Z)-octadecadienoic acid

In Other Databases

ChEBI CHEBI:91218
HMDb HMDB35919
PubChem 44559173
ChemSpider 22912859
ChEMBL CHEMBL469620