CHEBI:176133 - 7-Hydroxy-8-O-methylaloin B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 7-Hydroxy-8-O-methylaloin B
ChEBI ID CHEBI:176133
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C22H24O10
Net Charge 0
Average Mass 448.424
Monoisotopic Mass 448.13695
InChI InChI=1S/C22H24O10/c1-31-21-11(25)3-2-9-14(22-20(30)19(29)17(27)13(7-24)32-22)10-4-8(6-23)5-12(26)15(10)18(28)16(9)21/h2-5,13-14,17,19-20,22-27,29-30H,6-7H2,1H3
InChIKey HDIOAZQFHQKMAI-UHFFFAOYSA-N
SMILES O1C(C2C3=C(C(=O)C4=C2C=CC(O)=C4OC)C(O)=CC(=C3)CO)C(O)C(O)C(O)C1CO
ChEBI Ontology
Outgoing 7-Hydroxy-8-O-methylaloin B (CHEBI:176133) is a anthracenes (CHEBI:46955)
IUPAC Name
2,8-dihydroxy-6-(hydroxymethyl)-1-methoxy-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
Manual Xrefs Databases
35013373 ChemSpider
HMDB0031586 HMDB
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