(Q105278080)

English

[(4aR,5R,6R,8S,8aS)-8-hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-6-yl] 3-methylbut-2-enoate

chemical compound

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instance of

type of chemical entity

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subclass of

(8-Hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-6-yl) 3-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

346.178023932 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₅

0 references

canonical SMILES

O=C(OC1CC(O)C2C(=O)C=3OC=C(C3CC2(C)C1C)C)C=C(C)C

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isomeric SMILES

CC(C)=CC(=O)O[C@@H]1C[C@H](O)[C@H]2C(=O)c3occ(C)c3C[C@]2(C)[C@H]1C

0 references

found in taxon

Senecio smithii

1 reference

stated in

Furanoeremophilanes from Senecio smithii

Identifiers

InChI

InChI=1S/C20H26O5/c1-10(2)6-16(22)25-15-7-14(21)17-18(23)19-13(11(3)9-24-19)8-20(17,5)12(15)4/h6,9,12,14-15,17,21H,7-8H2,1-5H3/t12-,14-,15+,17-,20+/m0/s1

0 references

InChIKey

URYMRSQVBYUQKW-HDCQOPJRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

URYMRSQVBYUQKW-HDCQOPJRSA-N

(Q105278080)

[(4aR,5R,6R,8S,8aS)-8-hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-6-yl] 3-methylbut-2-enoate

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Identifiers

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