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CHEBI:182116 - 6,6',7-Trimethoxy-2,2'-dimethylberbaman-12-ol

ChEBI IDCHEBI:182116
ChEBI Name6,6',7-Trimethoxy-2,2'-dimethylberbaman-12-ol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC37H40N2O6
Net Charge0
Average Mass608.735
Monoisotopic Mass608.28864
SMILESCOc1cc2c3cc1Oc1c(OC)c(OC)cc4c1C(Cc1ccc(O)c(c1)Oc1ccc(cc1)CC3N(C)CC2)N(C)CC4
InChIInChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-31-18-23(8-11-30(31)40)17-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3
InChIKeyDFOCUWZXJBAUSQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6,6',7-Trimethoxy-2,2'-dimethylberbaman-12-ol (CHEBI:182116) is a phenylpropanoid (CHEBI:26004)
IUPAC Name 
20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol
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