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compound 0067114

PropertiesImage
MNX_IDMNXM1138689 Image of MNXM1138689
referenceenvipathM:...a6ba3526056b
formulaC24H36O6
global charge0
mol weight420.546
InChIKeyCUIVARRPMWGYGF-UHFFFAOYSA-N
InChIInChI=1S/C24H36O6/c1-3-5-10-20(14-16-26)18-30-24(28)22-13-7-6-12-21(22)23(27)29-17-19(4-2)11-8-9-15-25/h6-7,12-13,16,19-20,25H,3-5,8-11,14-15,17-18H2,1-2H3
SMILESCCCCC(CC=O)COC(=O)C1=C(C(=O)OCC(CC)CCCCO)C=CC=C1
MNX internals
InChI (mnx)InChI=1/C24H36O6/c1-3-5-10-20(14-16-26)18-30-24(28)22-13-7-6-12-21(22)23(27)29-17-19(4-2)11-8-9-15-25/h6-7,12-13,16,19-20,25H,3-5,8-11,14-15,17-18H2,1-2H3/t19?,20? Image of MNXM1138689
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:10][CH:20]([CH2:14][CH:16]=[O:26])[CH2:18][O:30][C:24]([C:22]1=[CH:13][CH:7]=[CH:6][CH:12]=[C:21]1[C:23](=[O:27])[O:29][CH2:17][CH:19]([CH2:4][CH3:2])[CH2:11][CH2:8][CH2:9][CH2:15][OH:25])=[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

envipath:...a6ba3526056b
envipathM:...a6ba3526056b
CUIVARRPMWGYGF-UHFFFAOYSA-N
compound 0067114