cemadotin (Q27265457)

UNII-6SQ8M7ZSFV (English)

14 October 2016

chemical formula

C₃₅H₅₆N₆O₅

1 reference

UNII-6SQ8M7ZSFV (English)

14 October 2016

canonical SMILES

CC(C)C(C(=O)N(C)C(C(C)C)C(=O)N1CCCC1C(=O)N2CCCC2C(=O)NCC3=CC=CC=C3)NC(=O)C(C(C)C)N(C)C

1 reference

UNII-6SQ8M7ZSFV (English)

14 October 2016

isomeric SMILES

CC(C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)NCC3=CC=CC=C3)NC(=O)[C@H](C(C)C)N(C)C

1 reference

UNII-6SQ8M7ZSFV (English)

InChI=1S/C35H56N6O5/c1-22(2)28(37-32(43)29(23(3)4)38(7)8)34(45)39(9)30(24(5)6)35(46)41-20-14-18-27(41)33(44)40-19-13-17-26(40)31(42)36-21-25-15-11-10-12-16-25/h10-12,15-16,22-24,26-30H,13-14,17-21H2,1-9H3,(H,36,42)(H,37,43)/t26-,27-,28-,29-,30-/m0/s1

14 October 2016

Identifiers

InChI

1 reference

UNII-6SQ8M7ZSFV (English)

14 October 2016

1 reference

Global Substance Registration System

UNII-6SQ8M7ZSFV (English)

14 October 2016

1 reference

UNII

6SQ8M7ZSFV

cemadotin (English)

14 October 2016

1 reference

Cemadotin (English)

14 October 2016

2 references

UNII-6SQ8M7ZSFV (English)

matched by identifier from

14 October 2016

1 reference

matched by identifier from

CEMADOTIN (English)

14 October 2016

2 references

inferred from InChIKey

Global Substance Registration System

1 reference

2 references

UNII

6SQ8M7ZSFV

cemadotin (English)

matched by identifier from

14 October 2016