(Q105158347)

English

2-Butenoic acid, 2-methyl-, 8-methyl-6-(2-methyl-1-oxobutoxy)-8-azabicyclo[3.2.1]oct-3-yl ester

group of stereoisomers with the chemical formula C₁₈H₂₉NO₄

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instance of

group of stereoisomers

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1 reference

323.209658408 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₉NO₄

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canonical SMILES

O=C(OC1CC2N(C)C(C1)C(OC(=O)C(C)CC)C2)C(=CC)C

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isomeric SMILES

C/C=C(\C)C(=O)OC1CC2CC(OC(=O)C(C)CC)C(C1)N2C

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Nine new tropane alkaloids from Datura stramonium L. identified by GC/MS

Identifiers

InChI

InChI=1S/C18H29NO4/c1-6-11(3)17(20)22-14-8-13-9-16(15(10-14)19(13)5)23-18(21)12(4)7-2/h6,12-16H,7-10H2,1-5H3/b11-6+

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InChIKey

LWJJYAYQOTXATC-IZZDOVSWSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LWJJYAYQOTXATC-IZZDOVSWSA-N

1 reference

(Q105158347)

2-Butenoic acid, 2-methyl-, 8-methyl-6-(2-methyl-1-oxobutoxy)-8-azabicyclo[3.2.1]oct-3-yl ester

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Identifiers

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