CID 10317002

7-hydroxydehydroglaucine

Structural Information

Molecular Formula
C21H23NO5
SMILES
CN1CCC2=CC(=C(C3=C2C1=C(C4=CC(=C(C=C43)OC)OC)O)OC)OC
InChI
InChI=1S/C21H23NO5/c1-22-7-6-11-8-16(26-4)21(27-5)18-12-9-14(24-2)15(25-3)10-13(12)20(23)19(22)17(11)18/h8-10,23H,6-7H2,1-5H3
InChIKey
XTYGTYHSWAJTPX-UHFFFAOYSA-N
Compound name
4,5,15,16-tetramethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaen-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

369.15762 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.16490 187.6
[M+Na]+ 392.14684 203.8
[M+NH4]+ 387.19144 195.6
[M+K]+ 408.12078 195.9
[M-H]- 368.15034 190.3
[M+Na-2H]- 390.13229 190.9
[M]+ 369.15707 190.9
[M]- 369.15817 190.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.