CID 480818

Gancaonin u

Structural Information

Molecular Formula
C24H28O4
SMILES
CC(=CCC1=C2CCC3=CC(=C(C=C3C2=C(C(=C1O)CC=C(C)C)O)O)O)C
InChI
InChI=1S/C24H28O4/c1-13(2)5-8-17-16-10-7-15-11-20(25)21(26)12-19(15)22(16)24(28)18(23(17)27)9-6-14(3)4/h5-6,11-12,25-28H,7-10H2,1-4H3
InChIKey
YJJXCOSDPIJFJR-UHFFFAOYSA-N
Compound name
6,8-bis(3-methylbut-2-enyl)-9,10-dihydrophenanthrene-2,3,5,7-tetrol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

380.19876 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.20604 194.3
[M+Na]+ 403.18798 206.1
[M+NH4]+ 398.23258 200.1
[M+K]+ 419.16192 199.7
[M-H]- 379.19148 194.9
[M+Na-2H]- 401.17343 194.6
[M]+ 380.19821 196.0
[M]- 380.19931 196.0
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.