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Dichotellate A

PropertiesImage
MNX_IDMNXM50530 Image of MNXM50530
referencechebi:169888
formulaC26H42O4
global charge0
mol weight418.618
InChIKeyOKHPUUNJBPCHEJ-CFDCDSIPSA-N
InChIInChI=1S/C26H42O4/c1-5-6-7-8-13-16-19-24(30-26(28)22-23(2)3)20-17-14-11-9-10-12-15-18-21-25(27)29-4/h10-14,16-17,20,23-24H,5-9,15,18-19,21-22H2,1-4H3/b12-10-,14-11+,16-13-,20-17+/t24-/m1/s1
SMILESCCCCC/C=C\C[C@H](/C=C/C=C/C/C=C\CCCC(=O)OC)OC(=O)CC(C)C
MNX internals
InChI (mnx)InChI=1/C26H42O4/c1-5-6-7-8-13-16-19-24(30-26(28)22-23(2)3)20-17-14-11-9-10-12-15-18-21-25(27)29-4/h10-14,16-17,20,23-24H,5-9,15,18-19,21-22H2,1-4H3/b12-10-,14-11+,16-13-,20-17+/t24-/m1/s1 Image of MNXM50530
SMILES (mnx)[CH3:1][CH2:5][CH2:6][CH2:7][CH2:8]/[CH:13]=[CH:16]\[CH2:19][C@H:24](/[CH:20]=[CH:17]/[CH:14]=[CH:11]/[CH2:9]/[CH:10]=[CH:12]\[CH2:15][CH2:18][CH2:21][C:25](=[O:27])[O:29][CH3:4])[O:30][C:26]([CH2:22][CH:23]([CH3:2])[CH3:3])=[O:28]
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:169888
chebi:169888
OKHPUUNJBPCHEJ-CFDCDSIPSA-N 		Dichotellate A
methyl (5Z,8E,10E,12R,14Z)-12-(3-methylbutanoyloxy)icosa-5,8,10,14-tetraenoate

lipidmaps:LMFA03000012
lipidmapsM:LMFA03000012
OKHPUUNJBPCHEJ-CFDCDSIPSA-N 		Dichotellate A
FA 26:5
Methyl 12R-(3-methylbutanoyloxy)-5Z,8E,10E,14Z-eicosatetraenoate
O2