(Q105347368)

English

(3-Hydroxy-3-isopropyl-6,8a-dimethyl-1,2,3a,4,5,8-hexahydroazulen-4-yl) 4-hydroxy-3-methoxy-benzoate

group of stereoisomers with the chemical formula C₂₃H₃₂O₅

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Statements

instance of

group of stereoisomers

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subclass of

daucane sesquiterpenoid

1 reference

inferred from

daucane sesquiterpenoid

mass

388.224974124 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₂O₅

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canonical SMILES

O=C(OC1CC(=CCC2(C)CCC(O)(C(C)C)C12)C)C3=CC=C(O)C(OC)=C3

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found in taxon

Ferula tenuisecta

1 reference

stated in

Structure and configuration of new coumarins of the roots of Ferula mogoltavica

Identifiers

InChI

InChI=1S/C23H32O5/c1-14(2)23(26)11-10-22(4)9-8-15(3)12-19(20(22)23)28-21(25)16-6-7-17(24)18(13-16)27-5/h6-8,13-14,19-20,24,26H,9-12H2,1-5H3

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InChIKey

YEQVRBJRNFLOQJ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YEQVRBJRNFLOQJ-UHFFFAOYSA-N

1 reference

(Q105347368)

(3-Hydroxy-3-isopropyl-6,8a-dimethyl-1,2,3a,4,5,8-hexahydroazulen-4-yl) 4-hydroxy-3-methoxy-benzoate

Statements

Identifiers

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