CID 74977387

Dolichin a

Structural Information

Molecular Formula

C₂₀H₂₀O₅

SMILES

CC(=C)C(CC1=C(C=CC2=C1OC3C2COC4=C3C=CC(=C4)O)O)O

InChI

InChI=1S/C20H20O5/c1-10(2)17(23)8-14-16(22)6-5-12-15-9-24-18-7-11(21)3-4-13(18)20(15)25-19(12)14/h3-7,15,17,20-23H,1,8-9H2,2H3

InChIKey

LRCYZCCKRIVTHN-UHFFFAOYSA-N

Compound name

10-(2-hydroxy-3-methylbut-3-enyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 340.13107 Da
Monoisotopic Mass: 3.2
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]+	341.138346	178.6
[M+Na]+	363.120288	185.6
[M-H]-	339.123794	182.3
[M+NH4]+	358.164893	192.4
[M+K]+	379.094228	182.7
[M+H-H2O]+	323.128330	173.2
[M+HCOO]-	385.129271	189.0
[M+CH3COO]-	399.144921	188.1
[M+Na-2H]-	361.105736	180.0
[M]+	340.13052142	179.6
[M]-	340.13161858	179.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.