(Q27264747)

salmeterol xinafoate (English)

14 October 2016

chemical formula

C₃₆H₄₅NO₇

1 reference

salmeterol xinafoate (English)

19 November 2016

canonical SMILES

C1=CC=C(C=C1)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O.C1=CC=C2C(=C1)C=CC(=C2O)C(=O)O

1 reference

salmeterol xinafoate (English)

https://nctr-crs.fda.gov/fdalabel/ui/spl-summaries/criteria/343802

19 November 2016

legal status (medicine)

boxed warning

1 reference

reference URL

FDA-sourced list of all drugs with black box warnings (Use Download Full Results and View Query links. (English)

subject has role

beta2-adrenergic agonist

1 reference

1-hydroxy-2-naphthoic acid

Medical Subject Headings

15 March 2018

1 reference

Medical Subject Headings

15 March 2018

0 references

0 references

Identifiers

InChI

InChI=1S/C25H37NO4.C11H8O3/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21;12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2;1-6,12H,(H,13,14)

1 reference

salmeterol xinafoate (English)

19 November 2016

2 references

salmeterol xinafoate (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

94749-08-3

2 references

salmeterol xinafoate (English)

19 November 2016

https://commonchemistry.cas.org/detail?cas_rn=94749-08-3

8 April 2021

1 reference

Salmeterol Xinafoate (English)

19 November 2016

2 references

salmeterol xinafoate (English)

19 November 2016

54687251

1 reference

ChEBI ID

9012

mapping relation type

exact match

2 references

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C25H37NO4.C11H8O3/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21;12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2;1-6,12H,(H,13,14)

1 reference

SALMETEROL XINAFOATE (English)

19 November 2016

2 references

inferred from InChIKey

DSSTox substance ID

DTXSID1045798

2 references

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

DSSTOX compound identifier

DTXCID9025798

0 references

EC number

638-765-3

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.166.379

27 December 2018

ECHA Substance Infocard ID

1-hydroxynaphthalene-2-carboxylic acid; 4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)-2-(hydroxymethyl)phenol (English)

quotation

CAS no.: 94749-08-3 (English)

100.166.379

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.166.379

27 December 2018

1-hydroxynaphthalene-2-carboxylic acid; 4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)-2-(hydroxymethyl)phenol (English)

quotation

CAS no.: 94749-08-3 (English)

MeSH descriptor ID

D000068299

subject named as

Salmeterol Xinafoate

0 references

MeSH tree code

D02.033.100.291.057.750

0 references

D02.092.063.291.057.750

0 references

D02.092.471.683.061.750

0 references

RxNorm ID

72616

1 reference

salmeterol xinafoate (English)

19 November 2016

2 references

salmeterol xinafoate (English)

19 November 2016

NDF-RT ID

N0000148375

1 reference

salmeterol xinafoate (English)

19 November 2016

0 references

1 reference

1 reference

salmeterol xinafoate (English)