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(Q105279146)
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English
1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.0²,⁶.0¹¹,¹³]pentadeca-3,8-dien-13-yl 2-methylbutanoate
group of stereoisomers with the chemical formula C₂₅H₃₆O₆
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Statements
instance of
group of stereoisomers
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subclass of
tigliane diterpenoid
1 reference
inferred from
tigliane diterpenoid
mass
432.25118887199983
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₃₆O₆
0 references
canonical SMILES
O=C(OC12CC(C)C3(O)C(C=C(CO)CC4(O)C(=O)C(=CC43)C)C1C2(C)C)C(C)CC
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Identifiers
InChI
InChI=1S/C25H36O6/c1-7-13(2)21(28)31-24-10-15(4)25(30)17(19(24)22(24,5)6)9-16(12-26)11-23(29)18(25)8-14(3)20(23)27/h8-9,13,15,17-19,26,29-30H,7,10-12H2,1-6H3
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InChIKey
UTWPUNYNNNYPEZ-UHFFFAOYSA-N
0 references
PubChem CID
14239459
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UTWPUNYNNNYPEZ-UHFFFAOYSA-N
UniChem compound ID
47315743
1 reference
stated in
UniChem
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