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CHEBI:182878 - 4,7-dimethyl-1-propan-2-yl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,5,6,8a-hexahydro-1H-naphthalen-2-one

ChEBI IDCHEBI:182878
ChEBI Name4,7-dimethyl-1-propan-2-yl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,5,6,8a-hexahydro-1H-naphthalen-2-one
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H34O7
Net Charge0
Average Mass398.496
Monoisotopic Mass398.23045
SMILESCC1=CC2C(CC1OC1OC(CO)C(O)C(O)C1O)C(C)CC(=O)C2C(C)C
InChIInChI=1S/C21H34O7/c1-9(2)17-13-5-11(4)15(7-12(13)10(3)6-14(17)23)27-21-20(26)19(25)18(24)16(8-22)28-21/h5,9-10,12-13,15-22,24-26H,6-8H2,1-4H3
InChIKeyFKHKXGQDMKLQLK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4,7-dimethyl-1-propan-2-yl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,5,6,8a-hexahydro-1H-naphthalen-2-one (CHEBI:182878) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
4,7-dimethyl-1-propan-2-yl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,4a,5,6,8a-hexahydro-1H-naphthalen-2-one
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