(Q105152539)

English

[(1S,2S,6S,8R,9S,10S,12S,14R)-8-hydroxy-9,14-dimethyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[7.5.0.02,6.012,14]tetradecan-10-yl] (Z)-2-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

8-hydroxy-9,14-dimethyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[7.5.0.0²,⁶.0¹²,¹⁴]tetradecan-10-yl 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

362.172938552 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆O₆

0 references

canonical SMILES

O=C(OC1CC2OC2(C)C3C4OC(=O)C(=C)C4CC(O)C13C)C(=CC)C

0 references

isomeric SMILES

C=C1C(=O)O[C@H]2[C@H]1C[C@@H](O)[C@@]1(C)[C@@H](OC(=O)/C(C)=C\C)C[C@@H]3O[C@]3(C)[C@H]21

0 references

found in taxon

Pluchea dioscoridis

2 references

stated in

A eudesmanolide from Pluchea dioscoridis

stated in

A eudesmanolide from Pluchea dioscoridis

Identifiers

InChI

InChI=1S/C20H26O6/c1-6-9(2)17(22)24-13-8-14-20(5,26-14)16-15-11(10(3)18(23)25-15)7-12(21)19(13,16)4/h6,11-16,21H,3,7-8H2,1-2,4-5H3/b9-6-/t11-,12+,13-,14-,15-,16+,19-,20-/m0/s1

0 references

InChIKey

LJFIXEDWUIJMPO-VMPDBILPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LJFIXEDWUIJMPO-VMPDBILPSA-N

(Q105152539)

[(1S,2S,6S,8R,9S,10S,12S,14R)-8-hydroxy-9,14-dimethyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[7.5.0.02,6.012,14]tetradecan-10-yl] (Z)-2-methylbut-2-enoate

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Identifiers

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