casokefamide (Q5048995)

Casokefamide (English)

14 October 2016

chemical formula

C₃₃H₄₀N₆O₇

1 reference

Casokefamide (English)

14 October 2016

canonical SMILES

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)N)NC(=O)C(CC3=CC=C(C=C3)O)N

1 reference

Casokefamide (English)

14 October 2016

isomeric SMILES

C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N)NC(=O)[C@H](CC3=CC=C(C=C3)O)N

1 reference

Casokefamide (English)

InChI=1S/C33H40N6O7/c1-19(36-32(45)26(34)16-22-8-12-24(40)13-9-22)31(44)39-28(18-21-6-4-3-5-7-21)33(46)37-20(2)30(43)38-27(29(35)42)17-23-10-14-25(41)15-11-23/h3-15,19-20,26-28,40-41H,16-18,34H2,1-2H3,(H2,35,42)(H,36,45)(H,37,46)(H,38,43)(H,39,44)/t19-,20-,26+,27+,28+/m1/s1

14 October 2016

Identifiers

InChI

1 reference

Casokefamide (English)

14 October 2016

1 reference

Global Substance Registration System

Casokefamide (English)

14 October 2016

1 reference

UNII

B453T1E8MP

casokefamide (English)

14 October 2016

1 reference

Casokefamide (English)

14 October 2016

2 references

Casokefamide (English)

matched by identifier from

14 October 2016

1 reference

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

CASOKEFAMIDE (English)

14 October 2016

1 reference

2 references

matched by identifier from

DSSTOX compound identifier

0 references

2 references

Global Substance Registration System

UNII

B453T1E8MP

casokefamide (English)

matched by identifier from

14 October 2016