CID 371258

Sanguilutine pseudobase

Structural Information

Molecular Formula
C23H23NO6
SMILES
CN1C2=C(C=CC3=CC(=C(C=C32)OC)OC)C4=C(C1=O)C(=C(C=C4OC)OC)OC
InChI
InChI=1S/C23H23NO6/c1-24-21-13(8-7-12-9-15(26-2)16(27-3)10-14(12)21)19-17(28-4)11-18(29-5)22(30-6)20(19)23(24)25/h7-11H,1-6H3
InChIKey
MPXWNNCONPUOGM-UHFFFAOYSA-N
Compound name
2,3,7,8,10-pentamethoxy-5-methylbenzo[c]phenanthridin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

409.15253 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.15981 198.0
[M+Na]+ 432.14175 210.7
[M-H]- 408.14525 204.5
[M+NH4]+ 427.18635 211.2
[M+K]+ 448.11569 207.6
[M+H-H2O]+ 392.14979 187.7
[M+HCOO]- 454.15073 217.2
[M+CH3COO]- 468.16638 231.7
[M+Na-2H]- 430.12720 202.4
[M]+ 409.15198 211.5
[M]- 409.15308 211.5
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