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Petasitin

PropertiesImageOccurences in reactions
MNX_IDMNXM129190Image of MNXM129190
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC20H28O4
charge0
mass332.19876
referencehmdb:HMDB0035637
InChIKeyITHGBLBTVGSKLJ-KPKJPENVSA-N
InChIInChI=1S/C20H28O4/c1-7-12(2)18(22)24-17-9-8-14-10-16(21)15(19(4,5)23)11-20(14,6)13(17)3/h7,10-11,13,17,23H,8-9H2,1-6H3/b12-7+
SMILESC/C=C(\C)C(=O)OC1CCC2=CC(=O)C(C(C)(C)O)=CC2(C)C1C
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0035637 Petasitin
7-(2-Hydroxypropan-2-yl)-1,8a-dimethyl-6-oxo-1,2,3,4,6,8a-hexahydronaphthalen-2-yl (2E)-2-methylbut-2-enoic acid
7-(2-hydroxypropan-2-yl)-1,8a-dimethyl-6-oxo-1,2,3,4,6,8a-hexahydronaphthalen-2-yl (2E)-2-methylbut-2-enoate
7-(2-hydroxypropan-2-yl)-1,8a-dimethyl-6-oxo-1,2,3,4-tetrahydronaphthalen-2-yl (2E)-2-methylbut-2-enoate
hmdb:HMDB35637 secondary/obsolete/fantasy identifier