CID 44258290

Oxidihydroartocarpesin

Structural Information

Molecular Formula
C20H18O7
SMILES
CC(C)(/C=C/C1=C(C2=C(C=C1O)OC(=CC2=O)C3=C(C=C(C=C3)O)O)O)O
InChI
InChI=1S/C20H18O7/c1-20(2,26)6-5-12-14(23)8-17-18(19(12)25)15(24)9-16(27-17)11-4-3-10(21)7-13(11)22/h3-9,21-23,25-26H,1-2H3/b6-5+
InChIKey
IOJDDCZZTXEPMG-AATRIKPKSA-N
Compound name
2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(E)-3-hydroxy-3-methylbut-1-enyl]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.10526 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.112536 185.2
[M+Na]+ 393.094478 194.4
[M-H]- 369.097984 188.5
[M+NH4]+ 388.139083 194.4
[M+K]+ 409.068418 190.6
[M+H-H2O]+ 353.102520 178.2
[M+HCOO]- 415.103461 198.5
[M+CH3COO]- 429.119111 209.6
[M+Na-2H]- 391.079926 188.3
[M]+ 370.10471142 187.7
[M]- 370.10580858 187.7
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.