(Q27105912)

Balfourodinium (English)

5 October 2016

chemical formula

C₁₇H₂₂NO₄⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(C)(C1CC2=C(C3=C(C(=CC=C3)OC)[N+](=C2O1)C)OC)O

1 reference

Balfourodinium (English)

5 October 2016

isomeric SMILES

CC(C)([C@H]1CC2=C(C3=C(C(=CC=C3)OC)[N+](=C2O1)C)OC)O

1 reference

Variability in tissue cultures of Choisy a ternata originating from a single tree

Balfourodinium (English)

5 October 2016

1 reference

Identifiers

InChI

InChI=1S/C17H22NO4/c1-17(2,19)13-9-11-15(21-5)10-7-6-8-12(20-4)14(10)18(3)16(11)22-13/h6-8,13,19H,9H2,1-5H3/q+1/t13-/m1/s1

1 reference

Balfourodinium (English)

OQZCPLGYHZLFBM-CYBMUJFWSA-N

5 October 2016

InChIKey

2 references

Balfourodinium (English)

5 October 2016

stated in

ChEBI release 2020-09-01

2 references

Balfourodinium (English)

OQZCPLGYHZLFBM-CYBMUJFWSA-N

5 October 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=38487-24-0

1 reference

(2R)-2-(2-Hydroxy-2-propanyl)-4,8-dimethoxy-9-methyl-2,3-dihydrofuro[2,3-b]quinolin-9-ium (English)

5 October 2016

1 reference

Balfourodinium (English)

5 October 2016

ChEBI ID

2986

mapping relation type

1 reference

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

Balfourodinium (English)

5 October 2016

1 reference

1 reference

DSSTOX compound identifier

0 references

1 reference

Balfourodinium (English)

5 October 2016

1 reference

Balfourodinium (English)