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6-O-Desmethyl-mycophenolic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM151493

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

formula

C₁₆H₁₈O₆

charge

mass

306.11034

reference

InChIKey

MHSRNZSBNXFMLF-FPYGCLRLSA-N

InChI

InChI=1S/C16H18O6/c1-8(4-6-12(17)18)3-5-10-14(19)9(2)11-7-22-16(21)13(11)15(10)20/h3,19-20H,4-7H2,1-2H3,(H,17,18)/b8-3+

SMILES

C/C(=C\Cc1c(O)c(C)c2c(c1O)C(=O)OC2)CCC(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:174929 chebi:174929	6-O-Desmethyl-mycophenolic acid (E)-6-(4,6-dihydroxy-7-methyl-3-oxo-1H-2-benzouran-5-yl)-4-methylhex-4-enoic acid
hmdb:HMDB0060788	6-O-Desmethyl-mycophenolic acid 6-(4,6-dihydroxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid 6-(4,6-dihydroxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid 6-O-Desmethyl-mycophenolate
hmdb:HMDB60788	secondary/obsolete/fantasy identifier