CID 156149

Kuwanon f

Structural Information

Molecular Formula

C₂₅H₂₆O₆

SMILES

CC(=CCCC1(C=CC2=CC(=C(C=C2O1)O)C3CC(=O)C4=C(C=C(C=C4O3)O)O)C)C

InChI

InChI=1S/C25H26O6/c1-14(2)5-4-7-25(3)8-6-15-9-17(18(27)12-21(15)31-25)22-13-20(29)24-19(28)10-16(26)11-23(24)30-22/h5-6,8-12,22,26-28H,4,7,13H2,1-3H3

InChIKey

FZAZNGMSARSUNC-UHFFFAOYSA-N

Compound name

5,7-dihydroxy-2-[7-hydroxy-2-methyl-2-(4-methylpent-3-enyl)chromen-6-yl]-2,3-dihydrochromen-4-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 0
Patents: 422.17294 Da
Monoisotopic Mass: 5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	423.180216	203.3
[M+Na]+	445.162158	210.5
[M-H]-	421.165664	209.0
[M+NH4]+	440.206763	212.9
[M+K]+	461.136098	207.6
[M+H-H2O]+	405.170200	194.8
[M+HCOO]-	467.171141	212.5
[M+CH3COO]-	481.186791	225.6
[M+Na-2H]-	443.147606	204.2
[M]+	422.17239142	204.9
[M]-	422.17348858	204.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.