(Q105029725)

English

[(1R)-5,6,7-trimethyl-4-methylidene-3,8,15-trioxo-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadeca-11(17),12-dien-7-yl] acetate

group of stereoisomers with the chemical formula C₂₀H₂₃NO₇

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Statements

instance of

group of stereoisomers

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subclass of

pyrrolizidine alkaloid

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inferred from

pyrrolizidine alkaloid

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389.147452076 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₃NO₇

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canonical SMILES

O=C1OC2C3=C(C=CN3C(=O)C2)COC(=O)C(OC(=O)C)(C)C(C)C(C1=C)C

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isomeric SMILES

C=C1C(=O)O[C@@H]2CC(=O)n3ccc(c32)COC(=O)C(C)(OC(C)=O)C(C)C1C

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found in taxon

Senecio canchahuinganquensis

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stated in

Sesquiterpenes with New Carbon Skeletons, Furoeremophilanes, Secoeremophilanes and other Constituents from Argentinian Senecio Species

Senecio pampeanus

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stated in

Sesquiterpenes with New Carbon Skeletons, Furoeremophilanes, Secoeremophilanes and other Constituents from Argentinian Senecio Species

Identifiers

InChI

InChI=1S/C20H23NO7/c1-10-11(2)18(24)27-15-8-16(23)21-7-6-14(17(15)21)9-26-19(25)20(5,12(10)3)28-13(4)22/h6-7,10,12,15H,2,8-9H2,1,3-5H3/t10?,12?,15-,20?/m1/s1

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InChIKey

HKLADSWGNVREOU-INKKCGMNSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HKLADSWGNVREOU-INKKCGMNSA-N

1 reference

(Q105029725)

[(1R)-5,6,7-trimethyl-4-methylidene-3,8,15-trioxo-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadeca-11(17),12-dien-7-yl] acetate

Statements

Identifiers

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