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ascr#20

PropertiesImage
MNX_IDMNXM152376 Image of MNXM152376
referencechebi:78958
formulaC18H34O6
global charge0
mol weight346.464
InChIKeySNWMNYQPRXIDAR-ORDFZIBCSA-N
InChIInChI=1S/C18H34O6/c1-13(23-18-16(20)12-15(19)14(2)24-18)10-8-6-4-3-5-7-9-11-17(21)22/h13-16,18-20H,3-12H2,1-2H3,(H,21,22)/t13-,14+,15-,16-,18-/m1/s1
SMILESC[C@H](CCCCCCCCCC(=O)O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
MNX internals
InChI (mnx)InChI=1/C18H34O6/c1-13(23-18-16(20)12-15(19)14(2)24-18)10-8-6-4-3-5-7-9-11-17(21)22/h13-16,18-20H,3-12H2,1-2H3,(H,21,22)/t13-,14+,15-,16-,18-/m1/s1 Image of MNXM152376
SMILES (mnx)[CH3:1][C@H:13]([CH2:10][CH2:8][CH2:6][CH2:4][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][C:17](=[O:21])[OH:22])[O:23][C@H:18]1[C@H:16]([OH:20])[CH2:12][C@@H:15]([OH:19])[C@H:14]([CH3:2])[O:24]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:78958
chebi:78958
SNWMNYQPRXIDAR-ORDFZIBCSA-N 		ascr#20
(11R)-11-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]dodecanoic acid
(11R)-11-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]lauric acid
11R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-dodecanoic acid
11R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-lauric acid

CHEBI:139647
chebi:139647
SNWMNYQPRXIDAR-ORDFZIBCSA-M 		ascr#20(1-)

lipidmaps:LMFA13040031
lipidmapsM:LMFA13040031
SNWMNYQPRXIDAR-ORDFZIBCSA-N 		ascr#20
11R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-dodecanoic acid
11R-(3,6-dideoxy-alpha-L-arabino-hexopyranosyloxy)-dodecanoic acid