(Q104933648)

English

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

chemical compound

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instance of

type of chemical entity

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subclass of

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

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canonical SMILES

O=C(OC1C2=C(OC=C2C)C(=O)C3CCC(O)C(C)C13C)C(=CC)C

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isomeric SMILES

C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]2CC[C@@H](O)[C@H](C)[C@@]12C

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found in taxon

Telanthophora grandifolia

1 reference

stated in

Further pyrrolizidine alkaloids and furoeremophilanes from Senecio species

Identifiers

InChI

InChI=1S/C20H26O5/c1-6-10(2)19(23)25-18-15-11(3)9-24-17(15)16(22)13-7-8-14(21)12(4)20(13,18)5/h6,9,12-14,18,21H,7-8H2,1-5H3/b10-6-/t12-,13-,14+,18+,20+/m0/s1

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InChIKey

BEWHLKZJDNKMGM-UEWLHAEMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BEWHLKZJDNKMGM-UEWLHAEMSA-N

(Q104933648)

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

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