CID 10532237

Bis(5-hydroxynoracronycine)

Structural Information

Molecular Formula
C38H34N2O8
SMILES
CC1(CC(C2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C5=C6C(=C7C(=C5O)C(=O)C8=C(N7C)C(=CC=C8)O)C=CC(O6)(C)C)C
InChI
InChI=1S/C38H34N2O8/c1-37(2)14-13-19-31-28(34(45)18-10-8-11-21(41)29(18)39(31)5)35(46)26(36(19)48-37)20-16-38(3,4)47-24-15-23(43)27-32(25(20)24)40(6)30-17(33(27)44)9-7-12-22(30)42/h7-15,20,41-43,46H,16H2,1-6H3
InChIKey
PIZIMOGOEZLCMG-UHFFFAOYSA-N
Compound name
5-(6,11-dihydroxy-3,3,12-trimethyl-7-oxo-1,2-dihydropyrano[2,3-c]acridin-1-yl)-6,11-dihydroxy-3,3,12-trimethylpyrano[2,3-c]acridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

646.2315 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 647.23878 266.0
[M+Na]+ 669.22072 286.5
[M+NH4]+ 664.26532 273.8
[M+K]+ 685.19466 273.5
[M-H]- 645.22422 274.3
[M+Na-2H]- 667.20617 268.0
[M]+ 646.23095 272.2
[M]- 646.23205 272.2
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.