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ascr#25

Properties

Image

Occurences in reactions

MNX_ID

MNXM152381

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

formula

C₂₁H₃₈O₆

charge

mass

386.26684

reference

chebi:78963

InChIKey

MTVUVHUAEUQKIN-YWWXTUTHSA-N

InChI

InChI=1S/C21H38O6/c1-16(26-21-19(23)15-18(22)17(2)27-21)13-11-9-7-5-3-4-6-8-10-12-14-20(24)25/h12,14,16-19,21-23H,3-11,13,15H2,1-2H3,(H,24,25)/b14-12+/t16-,17+,18-,19-,21-/m1/s1

SMILES

C[C@@H]1O[C@@H](O[C@H](C)CCCCCCCCCC/C=C/C(=O)O)[C@H](O)C[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:78963 chebi:78963	ascr#25 (2E,14R)-14-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]pentadec-2-enoic acid 14R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-2E-pentadecenoic acid
CHEBI:139662 chebi:139662	ascr#25(1-)
lipidmaps:LMFA13040012 lipidmapsM:LMFA13040012	ascr#25 14R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-2E-pentadecanoic acid 14R-(3,6-dideoxy-alpha-L-arabino-hexopyranosyloxy)-2E-pentadecanoic acid