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CHEBI:181284 - Podophyllotoxin, glucoside

ChEBI IDCHEBI:181284
ChEBI NamePodophyllotoxin, glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H32O13
Net Charge0
Average Mass576.551
Monoisotopic Mass576.18429
SMILESCOc1cc(C2c3cc4c(cc3C(OC3OC(CO)C(O)C(O)C3O)C3COC(=O)C23)OCO4)cc(OC)c1OC
InChIInChI=1S/C28H32O13/c1-34-17-4-11(5-18(35-2)26(17)36-3)20-12-6-15-16(39-10-38-15)7-13(12)25(14-9-37-27(33)21(14)20)41-28-24(32)23(31)22(30)19(8-29)40-28/h4-7,14,19-25,28-32H,8-10H2,1-3H3
InChIKeyNXVJTGLCCSFGAT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Podophyllotoxin, glucoside (CHEBI:181284) is a furonaphthodioxole (CHEBI:50307)
IUPAC Name 
5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzouro[6,5-][1,3]benzodioxol-8-one
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