CID 23758

N-methylcolchicine

Structural Information

Molecular Formula
C23H27NO6
SMILES
CC(=O)N(C)[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC
InChI
InChI=1S/C23H27NO6/c1-13(25)24(2)17-9-7-14-11-20(28-4)22(29-5)23(30-6)21(14)15-8-10-19(27-3)18(26)12-16(15)17/h8,10-12,17H,7,9H2,1-6H3/t17-/m0/s1
InChIKey
AHZFWPXTSZCLDJ-KRWDZBQOSA-N
Compound name
N-methyl-N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

413.18384 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 414.19112 196.0
[M+Na]+ 436.17306 202.3
[M+NH4]+ 431.21766 199.5
[M+K]+ 452.14700 199.9
[M-H]- 412.17656 197.0
[M+Na-2H]- 434.15851 197.0
[M]+ 413.18329 197.1
[M]- 413.18439 197.1
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.