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CHEBI:173290 - Deoxyrubroskyrin

ChEBI IDCHEBI:173290
ChEBI NameDeoxyrubroskyrin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H22O11
Net Charge0
Average Mass558.495
Monoisotopic Mass558.11621
SMILESCC1=CC(=O)c2c(O)c3c(c(O)c2C1=O)C1C(O)C(C3=O)C23C(=O)c4cc(C)cc(O)c4C(O)=C2C(=O)CC(O)C13
InChIInChI=1S/C30H22O11/c1-7-3-9-14(10(31)4-7)26(38)21-13(34)6-12(33)20-17-16-19(28(40)22(27(17)39)30(20,21)29(9)41)24(36)15-11(32)5-8(2)23(35)18(15)25(16)37/h3-5,12,17,20,22,27,31,33,36-39H,6H2,1-2H3
InChIKeyGJOVYUUFPQQOPS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Deoxyrubroskyrin (CHEBI:173290) is a anthraquinone (CHEBI:22580)
IUPAC Name 
8,10,14,18,25,28-hexahydroxy-6,21-dimethylheptacyclo[14.11.1.02,11.02,15.04,9.017,26.019,24]octacosa-4(9),5,7,10,17(26),18,21,24-octaene-3,12,20,23,27-pentone