(Q105251226)

English

(3R,5R,6S,7R,8Z)-7-hydroxy-8-[hydroxy(phenyl)methylidene]-6-methyl-1,3,5-tris(3-methylbut-2-enyl)tricyclo[4.3.1.03,7]decane-2,9-dione

group of stereoisomers with the chemical formula C₃₃H₄₂O₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

502.308309824 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₂O₄

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canonical SMILES

O=C1C(=C(O)C=2C=CC=CC2)C3(O)C4(C(=O)C1(CC=C(C)C)CC3(C)C(CC=C(C)C)C4)CC=C(C)C

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isomeric SMILES

CC(C)=CC[C@@H]1C[C@@]2(CC=C(C)C)C(=O)C3(CC=C(C)C)C[C@]1(C)[C@]2(O)/C(=C(/O)c1ccccc1)C3=O

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found in taxon

Triadenum japonicum

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stated in

Prenylated benzophenones from Triadenum japonicum.

Hypericum fauriei

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stated in

Prenylated benzophenones from Triadenum japonicum.

Identifiers

InChI

InChI=1S/C33H42O4/c1-21(2)13-14-25-19-32(18-16-23(5)6)29(36)31(17-15-22(3)4)20-30(25,7)33(32,37)26(28(31)35)27(34)24-11-9-8-10-12-24/h8-13,15-16,25,34,37H,14,17-20H2,1-7H3/b27-26+/t25-,30+,31?,32+,33-/m1/s1

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InChIKey

SEJBFXIKYPRBLV-XUFYULBLSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SEJBFXIKYPRBLV-XUFYULBLSA-N

1 reference

(Q105251226)

(3R,5R,6S,7R,8Z)-7-hydroxy-8-[hydroxy(phenyl)methylidene]-6-methyl-1,3,5-tris(3-methylbut-2-enyl)tricyclo[4.3.1.03,7]decane-2,9-dione

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Identifiers

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