CID 5378702

11-hydroxynoracronycine

Structural Information

Molecular Formula
C19H17NO4
SMILES
CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C
InChI
InChI=1S/C19H17NO4/c1-19(2)8-7-10-14(24-19)9-13(22)15-17(10)20(3)16-11(18(15)23)5-4-6-12(16)21/h4-9,21-22H,1-3H3
InChIKey
JZQDCDLYNFZBIG-UHFFFAOYSA-N
Compound name
6,11-dihydroxy-3,3,12-trimethylpyrano[2,3-c]acridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

6
Patents

323.11575 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.12303 174.5
[M+Na]+ 346.10497 188.0
[M-H]- 322.10847 179.4
[M+NH4]+ 341.14957 190.8
[M+K]+ 362.07891 183.5
[M+H-H2O]+ 306.11301 166.2
[M+HCOO]- 368.11395 190.1
[M+CH3COO]- 382.12960 186.5
[M+Na-2H]- 344.09042 182.4
[M]+ 323.11520 179.7
[M]- 323.11630 179.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.