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(Q105194037)
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English
[3,7,8-trihydroxy-3,4,8,8a-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethenyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate
group of stereoisomers with the chemical formula C₂₇H₃₄O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
clerodane diterpenoid
1 reference
inferred from
clerodane diterpenoid
mass
470.2304534279998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₃₄O₇
0 references
canonical SMILES
O=C1OCC(C=CC2(C)C3CCC(O)C(O)(C)C3(C)C(OC(=O)C=4C=CC=CC4)CC2(O)C)=C1
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Identifiers
InChI
InChI=1S/C27H34O7/c1-24(13-12-17-14-22(29)33-16-17)19-10-11-20(28)27(4,32)26(19,3)21(15-25(24,2)31)34-23(30)18-8-6-5-7-9-18/h5-9,12-14,19-21,28,31-32H,10-11,15-16H2,1-4H3
0 references
InChIKey
OLMPIDWZCBHRNQ-UHFFFAOYSA-N
0 references
PubChem CID
78410469
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OLMPIDWZCBHRNQ-UHFFFAOYSA-N
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