CID 135439140

Coelenterazine hcp

Structural Information

Molecular Formula
C25H25N3O2
SMILES
C1CCC(C1)CC2=NC(=CN3C2=NC(=C3O)CC4=CC=CC=C4)C5=CC=C(C=C5)O
InChI
InChI=1S/C25H25N3O2/c29-20-12-10-19(11-13-20)23-16-28-24(21(26-23)14-17-8-4-5-9-17)27-22(25(28)30)15-18-6-2-1-3-7-18/h1-3,6-7,10-13,16-17,29-30H,4-5,8-9,14-15H2
InChIKey
UCSBOFLEOACXIR-UHFFFAOYSA-N
Compound name
2-benzyl-8-(cyclopentylmethyl)-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

970
Patents

399.19467 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.20195 199.3
[M+Na]+ 422.18389 215.0
[M+NH4]+ 417.22849 206.7
[M+K]+ 438.15783 209.8
[M-H]- 398.18739 205.9
[M+Na-2H]- 420.16934 208.2
[M]+ 399.19412 203.5
[M]- 399.19522 203.5
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

patents stripe