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CHEBI:78999 - (2E,16R)-16-hydroxyheptadec-2-enoic acid

ChEBI IDCHEBI:78999
ChEBI Name(2E,16R)-16-hydroxyheptadec-2-enoic acid
Stars
ASCII Name(2E,16R)-16-hydroxyheptadec-2-enoic acid
DefinitionAn (ω−1)-hydroxy fatty acid that is (2E)-heptadec-2-enoic acid in which the 16-pro-R hydrogen is replaced by a hydroxy group.
Last Modified9 June 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC17H32O3
Net Charge0
Average Mass284.440
Monoisotopic Mass284.23514
SMILESC[C@@H](O)CCCCCCCCCCCC/C=C/C(=O)O
InChIInChI=1S/C17H32O3/c1-16(18)14-12-10-8-6-4-2-3-5-7-9-11-13-15-17(19)20/h13,15-16,18H,2-12,14H2,1H3,(H,19,20)/b15-13+/t16-/m1/s1
InChIKeyBPRRRSLYEXDKMT-QJPKHSJYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(2E,16R)-16-hydroxyheptadec-2-enoic acid (CHEBI:78999) has functional parent (2E)-2-heptadecenoic acid (CHEBI:79000)
(2E,16R)-16-hydroxyheptadec-2-enoic acid (CHEBI:78999) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
(2E,16R)-16-hydroxyheptadec-2-enoic acid (CHEBI:78999) is a hydroxy monounsaturated fatty acid (CHEBI:131869)
(2E,16R)-16-hydroxyheptadec-2-enoic acid (CHEBI:78999) is a long-chain fatty acid (CHEBI:15904)
(2E,16R)-16-hydroxyheptadec-2-enoic acid (CHEBI:78999) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
Incoming Relation(s)
ascr#29 (CHEBI:78967) has functional parent (2E,16R)-16-hydroxyheptadec-2-enoic acid (CHEBI:78999)
IUPAC Name 
(2E,16R)-16-hydroxyheptadec-2-enoic acid