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1-phenyl-3-(2,4,6-trihydroxyphenyl)propane-1,3-dione
MNXM114391 is deprecated and here replaced by MNXM1364769
!!! Alternative mappings exist !!!
| Properties | Image |
| MNX_ID | MNXM1364769 |
 |
| reference | metacycM:CPD-15078 |
| formula | C15H12O5 |
| global charge | 0 |
| mol weight | 272.256 |
| InChIKey | WLHWYWTVMPZGJG-UHFFFAOYSA-N |
| InChI | InChI=1S/C15H12O5/c16-10-6-12(18)15(13(19)7-10)14(20)8-11(17)9-4-2-1-3-5-9/h1-7,16,18-19H,8H2 |
| SMILES | O=C(CC(=O)C1=C(O)C=C(O)C=C1O)C1=CC=CC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C15H12O5/c16-10-6-12(18)15(13(19)7-10)14(20)8-11(17)9-4-2-1-3-5-9/h1-7,16,18-19H,8H2 |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:9]([C:11]([CH2:8][C:14]([C:15]2=[C:12]([OH:18])[CH:6]=[C:10]([OH:16])[CH:7]=[C:13]2[OH:19])=[O:20])=[O:17])[CH:5]=[CH:3]1 |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
| Identifier | Description |
metacyc.compound:CPD-15078 metacycM:CPD-15078 WLHWYWTVMPZGJG-UHFFFAOYSA-N
| 1-phenyl-3-(2,4,6-trihydroxyphenyl)propane-1,3-dione 2,5,7-trihydroxyflavanone dibenzoylmethane tautomer
|