CID 10507216
Neoacrimarine h
Structural Information
- Molecular Formula
- C33H29NO8
- SMILES
- CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4OC5C(C(OC6=C5C7=C(C=C6)C=CC(=O)O7)(C)C)O)C)O)C
- InChI
- InChI=1S/C33H29NO8/c1-32(2)14-13-17-22(41-32)15-19(35)24-27(17)34(5)26-18(28(24)37)7-6-8-21(26)39-30-25-20(42-33(3,4)31(30)38)11-9-16-10-12-23(36)40-29(16)25/h6-15,30-31,35,38H,1-5H3
- InChIKey
- KYDGDSAPWLVOME-UHFFFAOYSA-N
- Compound name
- 6-hydroxy-11-[(9-hydroxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl)oxy]-3,3,12-trimethylpyrano[2,3-c]acridin-7-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 568.19661 | 241.7 |
[M+Na]+ | 590.17855 | 253.9 |
[M-H]- | 566.18205 | 251.7 |
[M+NH4]+ | 585.22315 | 247.5 |
[M+K]+ | 606.15249 | 253.4 |
[M+H-H2O]+ | 550.18659 | 225.5 |
[M+HCOO]- | 612.18753 | 246.8 |
[M+CH3COO]- | 626.20318 | 248.3 |
[M+Na-2H]- | 588.16400 | 245.5 |
[M]+ | 567.18878 | 250.6 |
[M]- | 567.18988 | 250.6 |