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CHEBI:199012 - (3S,3'S,4S,4'S)-3,3'-Dimethyl-7,7',9,9'-tetramethoxy-3,3',4,4'-tetrahydro-5,6'-bi(1H-naphtho[2,3-c]pyran)-4,4',10,10'-tetrol

ChEBI IDCHEBI:199012
ChEBI Name(3S,3'S,4S,4'S)-3,3'-Dimethyl-7,7',9,9'-tetramethoxy-3,3',4,4'-tetrahydro-5,6'-bi(1H-naphtho[2,3-c]pyran)-4,4',10,10'-tetrol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H34O10
Net Charge0
Average Mass578.614
Monoisotopic Mass578.21520
SMILESCOc1cc(OC)c2c(O)c3c(c(-c4c(OC)cc(OC)c5c(O)c6c(cc45)[C@H](O)[C@H](C)OC6)c2c1)[C@H](O)[C@H](C)OC3
InChIInChI=1S/C32H34O10/c1-13-29(33)16-9-18-24(22(39-5)10-23(40-6)26(18)31(35)19(16)11-41-13)27-17-7-15(37-3)8-21(38-4)25(17)32(36)20-12-42-14(2)30(34)28(20)27/h7-10,13-14,29-30,33-36H,11-12H2,1-6H3/t13-,14-,29+,30+/m0/s1
InChIKeyWRSWUZPYBGDARY-CUAUGLLKSA-N
Species of MetaboliteComponentSourceComments
Cordyceps (ncbitaxon:45234) - PubMed (11269712)
ChEBI Ontology
Outgoing Relation(s)
(3S,3'S,4S,4'S)-3,3'-Dimethyl-7,7',9,9'-tetramethoxy-3,3',4,4'-tetrahydro-5,6'-bi(1H-naphtho[2,3-c]pyran)-4,4',10,10'-tetrol (CHEBI:199012) is a lignan (CHEBI:25036)
IUPAC Name 
(3S,4S)-6-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-5-yl]-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,10-diol
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