(Q104994236)

English

(E)-2-Methyl-2-butenoic acid [(4S)-4,4a,5,6,7,8,8aalpha,9-octahydro-8alpha-hydroxy-3,4abeta,5beta-trimethyl-9-oxonaphtho[2,3-b]furan-4beta-yl] ester

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(8-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

stereoisomer of

6beta-Angeloyloxy-1alpha-hydroxy-9-oxo-10alphaH-furanoeremophilane

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆O₅

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canonical SMILES

O=C(OC1C2=C(OC=C2C)C(=O)C3C(O)CCC(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]2[C@@H](O)CC[C@H](C)[C@@]12C

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found in taxon

Senecio umbellatus

1 reference

stated in

Natürlich vorkommende Terpen-Derivate, 78. Weitere Inhaltsstoffe aus südafrikanischenSenecio-Arten

Identifiers

InChI

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

0 references

InChIKey

FEVYLFPXBKQRPU-QBSSENITSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FEVYLFPXBKQRPU-QBSSENITSA-N

1 reference

(Q104994236)

(E)-2-Methyl-2-butenoic acid [(4S)-4,4a,5,6,7,8,8aalpha,9-octahydro-8alpha-hydroxy-3,4abeta,5beta-trimethyl-9-oxonaphtho[2,3-b]furan-4beta-yl] ester

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Identifiers

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