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(Q104194141)
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English
2,3,4'-trihydroxy-7'-(2-hydroxyethyl)-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-6'-one
group of stereoisomers with the chemical formula C₂₅H₃₅NO₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
drimane sesquiterpenoid
1 reference
inferred from
drimane sesquiterpenoid
isoindole alkaloid
1 reference
inferred from
isoindole alkaloid
mass
445.2464378399999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₃₅NO₆
0 references
canonical SMILES
O=C1C2=CC(O)=C3C(OC4(C3)C(C)CCC5C(C)(C)C(O)C(O)CC54C)=C2CN1CCO
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Identifiers
InChI
InChI=1S/C25H35NO6/c1-13-5-6-19-23(2,3)21(30)18(29)11-24(19,4)25(13)10-15-17(28)9-14-16(20(15)32-25)12-26(7-8-27)22(14)31/h9,13,18-19,21,27-30H,5-8,10-12H2,1-4H3
0 references
InChIKey
PAILZINGRRXKCY-UHFFFAOYSA-N
0 references
PubChem CID
85096341
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PAILZINGRRXKCY-UHFFFAOYSA-N
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