saxagliptin hydrochloride dihydrate (Q27260182)

UNII-4N19ON48ZN (English)

14 October 2016

chemical formula

C₁₈H₃₀ClN₃O₄

1 reference

UNII-4N19ON48ZN (English)

14 October 2016

canonical SMILES

C1C2CC2N(C1C#N)C(=O)C(C34CC5CC(C3)CC(C5)(C4)O)N.O.O.Cl

1 reference

UNII-4N19ON48ZN (English)

14 October 2016

isomeric SMILES

C1[C@@H]2C[C@@H]2N([C@@H]1C#N)C(=O)[C@H](C34CC5CC(C3)CC(C5)(C4)O)N.O.O.Cl

1 reference

UNII-4N19ON48ZN (English)

InChI=1S/C18H25N3O2.ClH.2H2O/c19-8-13-2-12-3-14(12)21(13)16(22)15(20)17-4-10-1-11(5-17)7-18(23,6-10)9-17;;;/h10-15,23H,1-7,9,20H2;1H;2*1H2/t10?,11?,12-,13+,14+,15-,17?,18?;;;/m1.../s1

14 October 2016

Identifiers

InChI

1 reference

UNII-4N19ON48ZN (English)

AJXATZPZZXZZRE-ZEGDOHPJSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-4N19ON48ZN (English)

14 October 2016

1 reference

UNII

4N19ON48ZN

saxagliptin hydrochloride dihydrate (English)

14 October 2016

1 reference

(1S,3S,5S)-2-[(2S)-2-Amino-2-(3-hydroxyadamantan-1-yl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile hydrochloride dihydrate (English)

14 October 2016

1 reference

Global Substance Registration System

UNII-4N19ON48ZN (English)

14 October 2016

1 reference

2 references

UNII

4N19ON48ZN

saxagliptin hydrochloride dihydrate (English)