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(Q105252616)
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English
2-[2-(5-Hydroxy-6-methoxy-4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)propoxy]-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
group of stereoisomers with the chemical formula C₂₇H₄₂O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
cadinane sesquiterpenoid
1 reference
inferred from
cadinane sesquiterpenoid
mass
558.2676267839997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₄₂O₁₂
0 references
canonical SMILES
OC=1C(OC)=C(C=C2C1C(C)CCC2C(C)COC3OC(COC4OCC(O)C(O)C4O)C(O)C(O)C3O)C
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Identifiers
InChI
InChI=1S/C27H42O12/c1-11-5-6-14(15-7-12(2)25(35-4)21(31)18(11)15)13(3)8-36-27-24(34)22(32)20(30)17(39-27)10-38-26-23(33)19(29)16(28)9-37-26/h7,11,13-14,16-17,19-20,22-24,26-34H,5-6,8-10H2,1-4H3
0 references
InChIKey
SGTULVUZPPHXQU-UHFFFAOYSA-N
0 references
PubChem CID
163094627
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SGTULVUZPPHXQU-UHFFFAOYSA-N
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