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9,10-dihydroxyoctadecanoate

PropertiesImage
MNX_IDMNXM729056 Image of MNXM729056
referencechebi:85197
formulaC18H35O4
global charge-1
mol weight315.474
InChIKeyVACHUYIREGFMSP-UHFFFAOYSA-M
InChIInChI=1S/C18H36O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h16-17,19-20H,2-15H2,1H3,(H,21,22)/p-1
SMILESCCCCCCCCC(O)C(O)CCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C18H36O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h16-17,19-20H,2-15H2,1H3,(H,21,22)/t16?,17? Image of MNXM729056
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:7][CH2:10][CH2:13][CH:16]([CH:17]([CH2:14][CH2:11][CH2:8][CH2:6][CH2:9][CH2:12][CH2:15][C:18](=[O:21])[OH:22])[OH:20])[OH:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:85197
chebi:85197
VACHUYIREGFMSP-UHFFFAOYSA-M 		9,10-dihydroxyoctadecanoate
9,10-dihydroxystearate
hmdb:HMDB0303981
VACHUYIREGFMSP-UHFFFAOYSA-M 		(9R,10S)-dihydroxystearate
(9R,10S)-Dihydroxystearic acid
9,10-Dihydroxyoctadecanoate
9,10-Dihydroxyoctadecanoic acid
9,10-Dihydroxystearic acid
9,10-dihydroxyoctadecanoate
9,10-dihydroxystearate

seed.compound:cpd20875
seedM:cpd20875
kegg.compound:C19622
keggC:C19622
VACHUYIREGFMSP-UHFFFAOYSA-M
VACHUYIREGFMSP-UHFFFAOYSA-N 		9,10-Dihydroxystearate

sabiork.compound:10413
sabiorkM:10413
VACHUYIREGFMSP-UHFFFAOYSA-N 		9,10-Dihydroxystearic acid
hmdb:HMDB0302281
VACHUYIREGFMSP-UHFFFAOYSA-N 		9,10-Dihydroxystearic acid
9,10-DHSA
9,10-DiOH 18:0
9,10-DiOH C18:0
9,10-Dihydroxyoctadecanoate
9,10-Dihydroxystearate
9,10-Dihydroxystearic acid, (r*,r*)-isomer
9,10-Dihydroxystearic acid, (r*,s*)-isomer
9,10-Dihydroxystearic acid, ammonium salt
9,10-Dihydroxystearic acid, dicalcium salt
9,10-Dihydroxystearic acid, lithium salt
9,10-Dihydroxystearic acid, magnesium salt
9,10-Dihydroxystearic acid, monocalcium salt
9,10-Dihydroxystearic acid, potassium salt
9,10-Dihydroxystearic acid, sodium salt
9,10-Dihydroxystearinsaeure
9,10-dihydroxyoctadecanoic acid
9,10-dihydroxystearic acid
DHSA
Dioxystearinsaeure

SLM:000501371
slm:000501371
VACHUYIREGFMSP-UHFFFAOYSA-M 		9,10-dihydroxyoctadecanoate

CHEBI:28724
chebi:28724
VACHUYIREGFMSP-UHFFFAOYSA-N 		9,10-dihydroxyoctadecanoic acid
9,10-DHSA
9,10-Dihydroxystearinsaeure
9,10-diOH 18:0
9,10-diOH C18:0
9,10-dihydroxystearic acid
DHSA
Dioxystearinsaeure

lipidmaps:LMFA02000142
lipidmapsM:LMFA02000142
VACHUYIREGFMSP-UHFFFAOYSA-N 		9,10-dihydroxystearic acid
9,10-DiHODA
9,10-dihydroxy-octadecanoic acid
Dihydroxystearic acid
FA 18:0
O2

chebi:20815
chebi:20816
chebi:2329
keggC:M_C19622
seedM:M_cpd20875 		secondary/obsolete/fantasy identifier