(Q27103030)

1,2-Dehydroreticuline (English)

5 October 2016

chemical formula

C₁₉H₂₂NO₄⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C[N+]1=C(C2=CC(=C(C=C2CC1)OC)O)CC3=CC(=C(C=C3)OC)O

1 reference

Quaternary isoquinoline alkaloids from Xylopia parviflora

1,2-Dehydroreticuline (English)

5 October 2016

2 references

stated in

Quaternary isoquinoline alkaloids from Xylopia parviflora

Identifiers

InChI

InChI=1S/C19H21NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11H,6-8H2,1-3H3,(H-,21,22)/p+1

1 reference

1,2-Dehydroreticuline (English)

ZALYXKJOOUDZCC-UHFFFAOYSA-O

5 October 2016

InChIKey

2 references

1,2-Dehydroreticuline (English)

5 October 2016

stated in

ChEBI release 2020-09-01

2 references

reticulinylium (English)

ZALYXKJOOUDZCC-UHFFFAOYSA-O

5 October 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=16202-17-8

1 reference

7-Hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-3,4-dihydroisoquinolinium (English)

5 October 2016

1 reference

1,2-Dehydroreticuline (English)

5 October 2016

Reaxys registry number

4158880

1 reference

reticulinylium (English)

5 October 2016

ChEBI ID

18363

mapping relation type

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

reticulinylium (English)

5 October 2016

1 reference

1 reference

DSSTOX compound identifier

0 references

2 references

reticulinylium (English)