CID 15726096

Hoslundin

Structural Information

Molecular Formula
C23H18O7
SMILES
CC1=C(C(=O)C(=CO1)C2=C(C=C3C(=C2O)C(=O)C=C(O3)C4=CC=CC=C4)OC)OC
InChI
InChI=1S/C23H18O7/c1-12-23(28-3)21(25)14(11-29-12)19-17(27-2)10-18-20(22(19)26)15(24)9-16(30-18)13-7-5-4-6-8-13/h4-11,26H,1-3H3
InChIKey
FMCPZMXUDWPSID-UHFFFAOYSA-N
Compound name
5-hydroxy-7-methoxy-6-(5-methoxy-6-methyl-4-oxopyran-3-yl)-2-phenylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

406.10526 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.11254 195.7
[M+Na]+ 429.09448 207.4
[M-H]- 405.09798 208.4
[M+NH4]+ 424.13908 204.4
[M+K]+ 445.06842 206.2
[M+H-H2O]+ 389.10252 185.2
[M+HCOO]- 451.10346 215.7
[M+CH3COO]- 465.11911 225.0
[M+Na-2H]- 427.07993 199.5
[M]+ 406.10471 204.9
[M]- 406.10581 204.9
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

patents stripe