(Q105140997)

English

7-[[(1S,4aS,6S,8aR)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy]-6,8-dimethoxychromen-2-one

chemical compound

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type of chemical entity

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subclass of

7-[(6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methoxy]-6,8-dimethoxychromen-2-one

1 reference

based on heuristic

inferred from SMILES

mass

442.235538808 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

7-[[(1S,4aR,6S,8aS)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy]-6,8-dimethoxychromen-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

2H-1-Benzopyran-2-one, 6,8-dimethoxy-7-(((1R,4aR,6S,8aS)-1,4,4a,5,6,7,8,8a-octahydro-6-hydroxy-2,5,5,8a-tetramethyl-1-naphthalenyl)methoxy)-

1 reference

1 reference

C₂₆H₃₄O₆

0 references

canonical SMILES

O=C1OC=2C(OC)=C(OCC3C(=CCC4C(C)(C)C(O)CCC34C)C)C(OC)=CC2C=C1

0 references

isomeric SMILES

COc1cc2ccc(=O)oc2c(OC)c1OC[C@H]1C(C)=CC[C@@H]2C(C)(C)[C@@H](O)CC[C@]21C

0 references

found in taxon

Achillea pseudopectinata

1 reference

stated in

Naturally occurring sesquiterpene-coumarin ethers, VI. New sesquiterpene-isofraxidin ethers fromAchillea depressa

Achillea depressa

1 reference

stated in

Naturally occurring sesquiterpene-coumarin ethers, VI. New sesquiterpene-isofraxidin ethers fromAchillea depressa

Identifiers

InChI

InChI=1S/C26H34O6/c1-15-7-9-19-25(2,3)20(27)11-12-26(19,4)17(15)14-31-23-18(29-5)13-16-8-10-21(28)32-22(16)24(23)30-6/h7-8,10,13,17,19-20,27H,9,11-12,14H2,1-6H3/t17-,19+,20-,26-/m0/s1

0 references

InChIKey

KGVZBKUYBZGQCZ-FGFYRLLUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KGVZBKUYBZGQCZ-FGFYRLLUSA-N

(Q105140997)

7-[[(1S,4aS,6S,8aR)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy]-6,8-dimethoxychromen-2-one

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