lapaquistat (Q6488102)

UNII-PEZ79BV72X (English)

14 October 2016

chemical formula

C₃₁H₃₉ClN₂O₈

1 reference

UNII-PEZ79BV72X (English)

14 October 2016

canonical SMILES

CC(C)(CN1C2=C(C=C(C=C2)Cl)C(OC(C1=O)CC(=O)N3CCC(CC3)CC(=O)O)C4=C(C(=CC=C4)OC)OC)CO

1 reference

UNII-PEZ79BV72X (English)

14 October 2016

isomeric SMILES

CC(C)(CN1C2=C(C=C(C=C2)Cl)[C@H](O[C@@H](C1=O)CC(=O)N3CCC(CC3)CC(=O)O)C4=C(C(=CC=C4)OC)OC)CO

1 reference

UNII-PEZ79BV72X (English)

InChI=1S/C31H39ClN2O8/c1-31(2,18-35)17-34-23-9-8-20(32)15-22(23)28(21-6-5-7-24(40-3)29(21)41-4)42-25(30(34)39)16-26(36)33-12-10-19(11-13-33)14-27(37)38/h5-9,15,19,25,28,35H,10-14,16-18H2,1-4H3,(H,37,38)/t25-,28-/m1/s1

14 October 2016

Commons category

Lapaquistat

0 references

Identifiers

InChI

1 reference

UNII-PEZ79BV72X (English)

HDGUKVZPMPJBFK-LEAFIULHSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-PEZ79BV72X (English)

14 October 2016

2 references

UNII

PEZ79BV72X

lapaquistat (English)

HDGUKVZPMPJBFK-LEAFIULHSA-N

14 October 2016

InChIKey

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=189059-71-0

1 reference

LAPAQUISTAT (English)

14 October 2016

1 reference

UNII-PEZ79BV72X (English)

14 October 2016

1 reference

DSSTOX compound identifier

CHEMBL341976 (English)

14 October 2016

1 reference

0 references

0 references

1 reference

6 July 2021

CAS no.: 189059-71-0 (English)

Global Substance Registration System

Lapaquistat (English)

UNII

PEZ79BV72X

1 reference

stated in

UNII

PEZ79BV72X