(Q105285434)

English

1-[(2S,6S)-6-[(2S)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]butan-2-one

chemical compound

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instance of

type of chemical entity

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subclass of

piperidine alkaloids

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mass

289.204179104 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₇NO₂

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canonical SMILES

O=C(CC)CC1N(C)C(CCC1)CC(O)C=2C=CC=CC2

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isomeric SMILES

CCC(=O)C[C@@H]1CCC[C@@H](C[C@H](O)c2ccccc2)N1C

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found in taxon

Lobelia davidii

1 reference

stated in

Alkaloids triterpenoids of Lobelia davidii

Identifiers

InChI

InChI=1S/C18H27NO2/c1-3-17(20)12-15-10-7-11-16(19(15)2)13-18(21)14-8-5-4-6-9-14/h4-6,8-9,15-16,18,21H,3,7,10-13H2,1-2H3/t15-,16-,18-/m0/s1

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InChIKey

VFMQEDIHEJZHAD-BQFCYCMXSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VFMQEDIHEJZHAD-BQFCYCMXSA-N

(Q105285434)

1-[(2S,6S)-6-[(2S)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]butan-2-one

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Identifiers

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