(Q105275109)

English

(1S,4aR,5R,8aR)-5-[2-(furan-3-yl)ethyl]-6-(hydroxymethyl)-1,4a-dimethyl-2,3,4,5,8,8a-hexahydronaphthalene-1-carboxylic acid

chemical compound

In more languages

Statements

type of chemical entity

0 references

5-[2-(Furan-3-yl)ethyl]-6-(hydroxymethyl)-1,4a-dimethyl-2,3,4,5,8,8a-hexahydronaphthalene-1-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

332.198759376 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₈O₄

0 references

canonical SMILES

O=C(O)C1(C)CCCC2(C)C(C(=CCC12)CO)CCC3=COC=C3

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isomeric SMILES

C[C@]1(C(=O)O)CCC[C@]2(C)[C@@H](CCc3ccoc3)C(CO)=CC[C@@H]12

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Amphiachyris dracunculoides

1 reference

Labdane derivatives and flavones from Gutierrezia dracunculoides

Identifiers

InChI=1S/C20H28O4/c1-19-9-3-10-20(2,18(22)23)17(19)7-5-15(12-21)16(19)6-4-14-8-11-24-13-14/h5,8,11,13,16-17,21H,3-4,6-7,9-10,12H2,1-2H3,(H,22,23)/t16-,17+,19+,20-/m0/s1

0 references

ULGOGUNTFIHPHP-CUDHKJQZSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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