(Q105185434)

English

[(1S,4Z,6S,7S)-4-ethylidene-6,7-dimethyl-3,8,15-trioxo-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadeca-11(17),12-dien-7-yl] acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

(4-Ethylidene-6,7-dimethyl-3,8,15-trioxo-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadeca-11(17),12-dien-7-yl) acetate

1 reference

based on heuristic

inferred from SMILES

389.147452076 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

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

1 reference

based on heuristic

inferred from InChI

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

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₃NO₇

0 references

canonical SMILES

O=C1OC2C3=C(C=CN3C(=O)C2)COC(=O)C(OC(=O)C)(C)C(C)CC1=CC

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isomeric SMILES

C/C=C1/C[C@H](C)[C@](C)(OC(C)=O)C(=O)OCc2ccn3c2[C@H](CC3=O)OC1=O

0 references

Senecio magnificus

1 reference

Co-occurrence of pyrrolizidine alkaloids and acylpyrrols in Senecio magnificus and constituents of other australian Senecio species

Senecio quadridentatus

1 reference

Co-occurrence of pyrrolizidine alkaloids and acylpyrrols in Senecio magnificus and constituents of other australian Senecio species

1 reference

Further pyrrolizidine alkaloids and furoeremophilanes from Senecio species

Identifiers

InChI=1S/C20H23NO7/c1-5-13-8-11(2)20(4,28-12(3)22)19(25)26-10-14-6-7-21-16(23)9-15(17(14)21)27-18(13)24/h5-7,11,15H,8-10H2,1-4H3/b13-5-/t11-,15-,20-/m0/s1

0 references

NTGIQQBAUYBEBF-KKJULMBHSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

NTGIQQBAUYBEBF-KKJULMBHSA-N

UniChem compound ID

1 reference

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