CID 10203943
O-demethyl apixaban
Structural Information
- Molecular Formula
- C24H23N5O4
- SMILES
- C1CCN(C(=O)C1)C2=CC=C(C=C2)N3CCC4=C(C3=O)N(N=C4C(=O)N)C5=CC=C(C=C5)O
- InChI
- InChI=1S/C24H23N5O4/c25-23(32)21-19-12-14-28(16-6-4-15(5-7-16)27-13-2-1-3-20(27)31)24(33)22(19)29(26-21)17-8-10-18(30)11-9-17/h4-11,30H,1-3,12-14H2,(H2,25,32)
- InChIKey
- HGHLWAZFIGRAOT-UHFFFAOYSA-N
- Compound name
- 1-(4-hydroxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 446.18230 | 207.8 |
[M+Na]+ | 468.16424 | 213.0 |
[M-H]- | 444.16774 | 214.3 |
[M+NH4]+ | 463.20884 | 211.7 |
[M+K]+ | 484.13818 | 206.0 |
[M+H-H2O]+ | 428.17228 | 195.2 |
[M+HCOO]- | 490.17322 | 217.9 |
[M+CH3COO]- | 504.18887 | 213.6 |
[M+Na-2H]- | 466.14969 | 203.9 |
[M]+ | 445.17447 | 201.8 |
[M]- | 445.17557 | 201.8 |
Literature stripe
No literature data available for this compound.