CHEBI:192400 - 3,4-Dihydroxyrottlerin

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ChEBI Name 3,4-Dihydroxyrottlerin
ChEBI ID CHEBI:192400
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H28O10
Net Charge 0
Average Mass 548.544
Monoisotopic Mass 548.16825
InChI InChI=1S/C30H28O10/c1-13-24(35)17(27(38)22(14(2)31)25(13)36)12-18-26(37)16-9-10-30(3,4)40-29(16)23(28(18)39)20(33)8-6-15-5-7-19(32)21(34)11-15/h5-11,32,34-39H,12H2,1-4H3/b8-6+
InChIKey LXWIYZXWHIMUOX-SOFGYWHQSA-N
SMILES O1C(C=CC=2C1=C(C(O)=C(CC=3C(O)=C(C(O)=C(C3O)C(=O)C)C)C2O)C(=O)/C=C/C4=CC(O)=C(O)C=C4)(C)C
Metabolite of Species Details
Pinus radiata (NCBI:txid3347) Found in leaf (BTO:0000713). See: MetaboLights Study
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via diarylheptanoid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3,4-Dihydroxyrottlerin (CHEBI:192400) is a diarylheptanoid (CHEBI:78802)
IUPAC Name
(E)-1-[6-[(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-5,7-dihydroxy-2,2-dimethylchromen-8-yl]-3-(3,4-dihydroxyphenyl)prop-2-en-1-one
Manual Xrefs Databases
4475800 ChemSpider
LMPK12120269 LIPID MAPS
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