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1-20:2-2-18:3-digalactosyldiacylglycerol

Properties

Image

Occurences in reactions

MNX_ID

MNXM32613

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₅₃H₉₀O₁₅

charge

mass

966.62797

reference

metacycM:CPD-8424

InChIKey

XDZWXEXAMRUDOI-JISONETDSA-N

InChI

InChI=1S/C53H90O15/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-44(55)63-38-41(66-45(56)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2)39-64-52-51(62)49(60)47(58)43(68-52)40-65-53-50(61)48(59)46(57)42(37-54)67-53/h6,8,11-14,17-19,21,41-43,46-54,57-62H,3-5,7,9-10,15-16,20,22-40H2,1-2H3/b8-6-,13-11-,14-12-,19-17-,21-18-/t41-,42-,43-,46+,47+,48+,49+,50-,51-,52-,53+/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-8424 metacycM:CPD-8424	1-20:2-2-18:3-digalactosyldiacylglycerol 1-(11Z,14Z-eicosadienoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-3-O-[alpha-D-galactosyl-(1->6)-O-beta-D-galactosyl]-sn-glycerol 1-(11Z,14Z-icosadienoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-3-O-[alpha-D-galactosyl-(1->6)-O-beta-D-galactosyl]-sn-glycerol 20:2-18:3-DGDG
seed.compound:cpd25262 seedM:cpd25262	1-(11Z,14Z-eicosadienoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-3-O-[alpha-D-galactosyl-(1->6)-O-beta-D-galactosyl]-sn-glycerol 1-(11Z,14Z-icosadienoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-3-O-[alpha-D-galactosyl-(1->6)-O-beta-D-galactosyl]-sn-glycerol 1-20:2-2-18:3-digalactosyldiacylglycerol 20:2-18:3-DGDG
seedM:M_cpd25262	secondary/obsolete/fantasy identifier