Concept information
Preferred term
dihydro-nogalonic acid methyl ester
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C21H18O8
inchi
- InChI=1S/C21H18O8/c1-9(22)6-14(24)16-10(8-15(25)29-2)7-12-18(20(16)27)21(28)17-11(19(12)26)4-3-5-13(17)23/h3-5,7,9,22-23,27H,6,8H2,1-2H3
inchikey
- PUVXBJLNMVCYJW-UHFFFAOYSA-N
mass
- 398.367
monoisotopicmass
- 398.10017
smiles
- C1=CC(=C2C(=C1)C(C=3C(C2=O)=C(C(=C(C3)CC(OC)=O)C(CC(O)C)=O)O)=O)O
subset
- 3_STAR
synonym EXACT
- dihydro-nogalonic acid methyl ester
- methyl [4,5-dihydroxy-3-(3-hydroxybutanoyl)-9,10-dioxo-9,10-dihydroanthracen-2-yl]acetate
synonym RELATED
- 2-[4,5-dihydroxy-3-(3-hydroxybutanoyl)-9,10-diketo-2-anthryl]acetic acid methyl ester
- methyl 2-[4,5-dihydroxy-3-(3-hydroxybutanoyl)-9,10-dioxo-2-anthryl]acetate
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:31486
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