anacetrapib (Q4750639)

Anacetrapib (English)

3 October 2016

chemical formula

C₃₀H₂₅F₁₀NO₃

1 reference

Anacetrapib (English)

3 October 2016

canonical SMILES

CC1C(OC(=O)N1CC2=C(C=CC(=C2)C(F)(F)F)C3=CC(=C(C=C3OC)F)C(C)C)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

1 reference

Anacetrapib (English)

3 October 2016

isomeric SMILES

C[C@H]1[C@H](OC(=O)N1CC2=C(C=CC(=C2)C(F)(F)F)C3=CC(=C(C=C3OC)F)C(C)C)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

1 reference

Anacetrapib (English)

3 October 2016

subject has role

anticholesteremic agents

1 reference

stated in

Medical Subject Headings

MeSH descriptor ID

C530884

InChI=1S/C30H25F10NO3/c1-14(2)22-11-23(25(43-4)12-24(22)31)21-6-5-18(28(32,33)34)9-17(21)13-41-15(3)26(44-27(41)42)16-7-19(29(35,36)37)10-20(8-16)30(38,39)40/h5-12,14-15,26H,13H2,1-4H3/t15-,26-/m0/s1

15 March 2018

Identifiers

InChI

1 reference

Anacetrapib (English)

MZZLGJHLQGUVPN-HAWMADMCSA-N

3 October 2016

InChIKey

1 reference

Global Substance Registration System

Anacetrapib (English)

3 October 2016

2 references

UNII

P7T269PR6S

ANACETRAPIB (English)

MZZLGJHLQGUVPN-HAWMADMCSA-N

3 October 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=875446-37-0

1 reference

Anacetrapib (English)

3 October 2016

1 reference

Anacetrapib (English)

3 October 2016

1 reference

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

ANACETRAPIB (English)

3 October 2016

1 reference

1 reference

DSSTOX compound identifier

DTXCID90158943

0 references

Guide to Pharmacology Ligand ID

8400

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

8400

anacetrapib (English)

3 October 2016

1 reference

Medical Subject Headings

14 March 2018

1 reference

Global Substance Registration System

Anacetrapib (English)

3 July 2018

1 reference

UNII

P7T269PR6S