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18:1-16:1-MGDG

PropertiesImage
MNX_IDMNXM7971 Image of MNXM7971
referencechebi:191330
formulaC43H78O10
global charge0
mol weight755.087
InChIKeyRVTDOBUXLKASID-NVMFGSTBSA-N
InChIInChI=1S/C43H78O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h17-19,22,36-37,40-44,47-49H,3-16,20-21,23-35H2,1-2H3/b18-17-,22-19-/t36-,37-,40+,41+,42-,43-/m1/s1
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C43H78O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h17-19,22,36-37,40-44,47-49H,3-16,20-21,23-35H2,1-2H3/b18-17-,22-19-/t36-,37-,40+,41+,42-,43-/m1/s1 Image of MNXM7971
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:18]\[CH2:20][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][C:38](=[O:45])[O:50][CH2:34][C@H:36]([CH2:35][O:51][C@H:43]1[C@H:42]([OH:49])[C@@H:41]([OH:48])[C@@H:40]([OH:47])[C@@H:37]([CH2:33][OH:44])[O:53]1)[O:52][C:39]([CH2:32][CH2:30][CH2:28][CH2:26][CH2:24]/[CH:22]=[CH:19]\[CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:46]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)14
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:191330
chebi:191330
RVTDOBUXLKASID-NVMFGSTBSA-N
18:1-16:1-MGDG
[(2S)-2-[(Z)-hexadec-7-enoyl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (Z)-octadec-9-enoate

seed.compound:cpd24373
seedM:cpd24373
RVTDOBUXLKASID-NVMFGSTBSA-N
1-(9Z-octadecenoyl)-2-(7Z-hexadecenoyl)-3-O-beta-D-galactosyl-sn-glycerol,
1-18:1-2-16:1-monogalactosyldiacylglycerol
18:1-16:1-MGDG

metacyc.compound:CPD-2188
metacycM:CPD-2188
RVTDOBUXLKASID-NVMFGSTBSA-N
1-18:1-2-16:1-monogalactosyldiacylglycerol
1-(9Z-octadecenoyl)-2-(7Z-hexadecenoyl)-3-O-beta-D-galactosyl-sn-glycerol,
18:1-16:1-MGDG

seedM:M_cpd24373
secondary/obsolete/fantasy identifier