(Q105023823)

English

[(5aR,6R,8S,9aS,9bR)-6-hydroxy-3-(hydroxymethyl)-5a-methyl-9-methylidene-2-oxo-5,6,7,8,9a,9b-hexahydro-4H-benzo[g][1]benzofuran-8-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

eudesmane sesquiterpenoid

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mass

322.141638424 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₂O₆

0 references

canonical SMILES

O=C1OC2C(=C1CO)CCC3(C)C(O)CC(OC(=O)C)C(=C)C23

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isomeric SMILES

C=C1[C@@H](OC(C)=O)C[C@@H](O)[C@]2(C)CCC3=C(CO)C(=O)O[C@@H]3[C@@H]12

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found in taxon

Artemisia judaica

1 reference

stated in

Glaucolide-like sesquiterpene lactones from Artemisia judaica

Identifiers

InChI

InChI=1S/C17H22O6/c1-8-12(22-9(2)19)6-13(20)17(3)5-4-10-11(7-18)16(21)23-15(10)14(8)17/h12-15,18,20H,1,4-7H2,2-3H3/t12-,13+,14+,15-,17-/m0/s1

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InChIKey

GYIOPRLVDDGIKJ-CLBVLKOUSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GYIOPRLVDDGIKJ-CLBVLKOUSA-N

(Q105023823)

[(5aR,6R,8S,9aS,9bR)-6-hydroxy-3-(hydroxymethyl)-5a-methyl-9-methylidene-2-oxo-5,6,7,8,9a,9b-hexahydro-4H-benzo[g][1]benzofuran-8-yl] acetate

Statements

Identifiers

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