(Q105030299)

English

(S)-4-[2-(Dimethylamino)ethyl]-4-(3,4-dimethoxyphenyl)-2-cyclohexene-1-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

4-(3,4-dimethoxyphenyl)-4-[2-(dimethylamino)ethyl]cyclohex-2-en-1-one

1 reference

based on heuristic

inferred from SMILES

mass

303.18344366 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₅NO₃

0 references

canonical SMILES

O=C1C=CC(C2=CC=C(OC)C(OC)=C2)(CC1)CCN(C)C

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isomeric SMILES

COc1ccc([C@@]2(CCN(C)C)C=CC(=O)CC2)cc1OC

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found in taxon

Mesembryanthemum tortuosum

1 reference

stated in

Sceletium alkaloids. Structures of five new bases from Sceletium namaquense

Identifiers

InChI

InChI=1S/C18H25NO3/c1-19(2)12-11-18(9-7-15(20)8-10-18)14-5-6-16(21-3)17(13-14)22-4/h5-7,9,13H,8,10-12H2,1-4H3/t18-/m0/s1

0 references

InChIKey

HLUBCMPIISFQMY-SFHVURJKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HLUBCMPIISFQMY-SFHVURJKSA-N

1 reference

(Q105030299)

(S)-4-[2-(Dimethylamino)ethyl]-4-(3,4-dimethoxyphenyl)-2-cyclohexene-1-one

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