CID 13965865

Honyumine

Structural Information

Molecular Formula
C20H19NO5
SMILES
CC1(C=CC2=C(O1)C=C3C(=C2O)C(=O)C4=C(N3C)C(=C(C=C4)O)OC)C
InChI
InChI=1S/C20H19NO5/c1-20(2)8-7-10-14(26-20)9-12-15(17(10)23)18(24)11-5-6-13(22)19(25-4)16(11)21(12)3/h5-9,22-23H,1-4H3
InChIKey
DCEKPLXGLUMXMB-UHFFFAOYSA-N
Compound name
5,9-dihydroxy-10-methoxy-2,2,11-trimethylpyrano[3,2-b]acridin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.1263 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.133576 182.4
[M+Na]+ 376.115518 195.9
[M-H]- 352.119024 187.4
[M+NH4]+ 371.160123 197.5
[M+K]+ 392.089458 192.1
[M+H-H2O]+ 336.123560 173.8
[M+HCOO]- 398.124501 197.6
[M+CH3COO]- 412.140151 194.0
[M+Na-2H]- 374.100966 189.2
[M]+ 353.12575142 189.7
[M]- 353.12684858 189.7
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.