CID 15478905

Dorsilurin d

Structural Information

Molecular Formula
C30H34O7
SMILES
CC(=CCC1=C(C(=C2C(=C1O)C(=O)C(=C(O2)C3=C(C=C(C=C3)O)O)CC=C(C)C)CC(C(=C)C)O)O)C
InChI
InChI=1S/C30H34O7/c1-15(2)7-10-20-26(34)22(14-23(32)17(5)6)30-25(27(20)35)28(36)21(11-8-16(3)4)29(37-30)19-12-9-18(31)13-24(19)33/h7-9,12-13,23,31-35H,5,10-11,14H2,1-4,6H3
InChIKey
PSGBQWWFQHLENG-UHFFFAOYSA-N
Compound name
2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-3,6-bis(3-methylbut-2-enyl)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

506.23044 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 507.23772 225.0
[M+Na]+ 529.21966 230.3
[M-H]- 505.22316 227.0
[M+NH4]+ 524.26426 228.4
[M+K]+ 545.19360 226.1
[M+H-H2O]+ 489.22770 217.0
[M+HCOO]- 551.22864 232.7
[M+CH3COO]- 565.24429 243.5
[M+Na-2H]- 527.20511 216.1
[M]+ 506.22989 228.2
[M]- 506.23099 228.2
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

No patent data available for this compound.