CID 118753696

Hydroxyapixaban (m7)

Structural Information

Molecular Formula
C25H25N5O5
SMILES
COC1=CC=C(C=C1)N2C3=C(CCN(C3=O)C4=CC=C(C=C4)N5CCC(CC5=O)O)C(=N2)C(=O)N
InChI
InChI=1S/C25H25N5O5/c1-35-19-8-6-17(7-9-19)30-23-20(22(27-30)24(26)33)11-13-29(25(23)34)16-4-2-15(3-5-16)28-12-10-18(31)14-21(28)32/h2-9,18,31H,10-14H2,1H3,(H2,26,33)
InChIKey
FVUAHXZIDHJDGX-UHFFFAOYSA-N
Compound name
6-[4-(4-hydroxy-2-oxopiperidin-1-yl)phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

475.18558 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 476.19286 215.0
[M+Na]+ 498.17480 220.2
[M-H]- 474.17830 221.7
[M+NH4]+ 493.21940 217.8
[M+K]+ 514.14874 214.0
[M+H-H2O]+ 458.18284 202.4
[M+HCOO]- 520.18378 224.8
[M+CH3COO]- 534.19943 220.4
[M+Na-2H]- 496.16025 210.2
[M]+ 475.18503 211.1
[M]- 475.18613 211.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.