(Q105173242)

English

[(1S,2S,3R,4aR,5R,8aR)-5-[2-(furan-3-yl)-2-oxoethyl]-3-hydroxy-1,4a-dimethyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalen-2-yl] acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

[5-[2-(Furan-3-yl)-2-oxoethyl]-3-hydroxy-1,4a-dimethyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalen-2-yl] acetate

1 reference

based on heuristic

inferred from SMILES

360.193673996 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₈O₅

0 references

canonical SMILES

O=C(OC1C(O)CC2(C)C(C(=C)CCC2C1C)CC(=O)C3=COC=C3)C

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isomeric SMILES

C=C1CC[C@@H]2[C@H](C)[C@H](OC(C)=O)[C@H](O)C[C@@]2(C)[C@@H]1CC(=O)c1ccoc1

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Austroeupatorium inulifolium

1 reference

Nine New Norlabdane Diterpenoids from the Leaves of Austroeupatorium inulifolium

Identifiers

InChI=1S/C21H28O5/c1-12-5-6-16-13(2)20(26-14(3)22)19(24)10-21(16,4)17(12)9-18(23)15-7-8-25-11-15/h7-8,11,13,16-17,19-20,24H,1,5-6,9-10H2,2-4H3/t13-,16+,17+,19+,20-,21+/m0/s1

0 references

MVRMFJSYFFKXJF-ZEHMMNKISA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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