(Q105130915)

English

(1S,2R)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-7-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

345.157622836 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₃NO₅

0 references

canonical SMILES

[O-][N+]1(C)CCC2=CC(OC)=C(O)C=C2C1CC3=CC=C(OC)C(O)=C3

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isomeric SMILES

COc1ccc(C[C@H]2c3cc(O)c(OC)cc3CC[N@@+]2(C)[O-])cc1O

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found in taxon

Pachygone ovata

1 reference

stated in

Constituents of Pachygone ovata and Pharmacological Action of its Major Leaf Alkaloid

Identifiers

InChI

InChI=1S/C19H23NO5/c1-20(23)7-6-13-10-19(25-3)17(22)11-14(13)15(20)8-12-4-5-18(24-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-,20+/m0/s1

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InChIKey

JLMWCKYUUMRSRK-MGPUTAFESA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JLMWCKYUUMRSRK-MGPUTAFESA-N

1 reference

(Q105130915)

(1S,2R)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-7-ol

Statements

Identifiers

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