(Q105152908)

English

[(1R,2R,5R,7R,8R,9R,10R,13R,16R,17R)-11-ethyl-16-hydroxy-13-methyl-6-methylidene-4-oxo-11-azahexacyclo[7.7.2.15,8.01,10.02,8.013,17]nonadecan-7-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(11-Ethyl-16-hydroxy-13-methyl-6-methylidene-4-oxo-11-azahexacyclo[7.7.2.15,8.01,10.02,8.013,17]nonadecan-7-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

399.240958536 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₃NO₄

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canonical SMILES

O=C(OC1C(=C)C2C(=O)CC3C1(C2)C4CC5C6(C)CN(CC)C4C35C(O)CC6)C

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isomeric SMILES

C=C1[C@H]2C[C@]3([C@@H]1OC(C)=O)[C@H]1C[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@]4([C@@H]1N(CC)C5)[C@@H]3CC2=O

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found in taxon

Aconitum soongaricum

1 reference

stated in

Alkaloids of the cultivated species Aconitum tauricum and Delphinium elatum

Aconitum soongoricum

1 reference

stated in

The pyrolysis of the aconitum alkaloids

Aconitum firmum

1 reference

stated in

Alkaloids of Aconitum firmum and A. tokii

Identifiers

InChI

InChI=1S/C24H33NO4/c1-5-25-11-22(4)7-6-19(28)24-17(22)8-15(20(24)25)23-10-14(16(27)9-18(23)24)12(2)21(23)29-13(3)26/h14-15,17-21,28H,2,5-11H2,1,3-4H3/t14-,15+,17-,18-,19-,20-,21-,22+,23+,24+/m1/s1

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InChIKey

LJYVUWQWNJKRNS-SXTZIVMFSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LJYVUWQWNJKRNS-SXTZIVMFSA-N

(Q105152908)

[(1R,2R,5R,7R,8R,9R,10R,13R,16R,17R)-11-ethyl-16-hydroxy-13-methyl-6-methylidene-4-oxo-11-azahexacyclo[7.7.2.15,8.01,10.02,8.013,17]nonadecan-7-yl] acetate

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Identifiers

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