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CHEBI:226976 - Diaporine

ChEBI IDCHEBI:226976
ChEBI NameDiaporine
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SubmitterMetaboLights
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FormulaC30H22O14
Net Charge0
Average Mass606.492
Monoisotopic Mass606.10096
SMILESCO[C@@]12O[C@]1([C@]13O[C@@]1(OC)C(=O)c1cc4oc(C)cc(=O)c4c(O)c1[C@H]3O)[C@H](O)c1c(cc3oc(C)cc(=O)c3c1O)C2=O
InChIInChI=1S/C30H22O14/c1-9-5-13(31)19-15(41-9)7-11-17(21(19)33)25(37)27(29(39-3,43-27)23(11)35)28-26(38)18-12(24(36)30(28,40-4)44-28)8-16-20(22(18)34)14(32)6-10(2)42-16/h5-8,25-26,33-34,37-38H,1-4H3/t25-,26-,27+,28+,29+,30+/m1/s1
InChIKeyLRQHODJQXLXCSC-MYTZRPOQSA-N
Species of MetaboliteComponentSourceComments
Diaporthespecies (ncbitaxon:1756133) - PubMed (25051017)
ChEBI Ontology
Outgoing Relation(s)
Diaporine (CHEBI:226976) is a organic heterotricyclic compound (CHEBI:26979)
Diaporine (CHEBI:226976) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(11R,12S,14R)-12-[(11R,12S,14R)-9,11-dihydroxy-14-methoxy-5-methyl-7,15-dioxo-4,13-dioxatetracyclo[8.5.0.03,8.012,14]pentadeca-1,3(8),5,9-tetraen-12-yl]-9,11-dihydroxy-14-methoxy-5-methyl-4,13-dioxatetracyclo[8.5.0.03,8.012,14]pentadeca-1,3(8),5,9-tetraene-7,15-dione
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