CID 5317481
Gancaonin d
Structural Information
- Molecular Formula
- C21H20O7
- SMILES
- C/C(=C\CC1=C2C(=C(C=C1O)O)C(=O)C(=CO2)C3=CC(=C(C=C3)OC)O)/CO
- InChI
- InChI=1S/C21H20O7/c1-11(9-22)3-5-13-15(23)8-17(25)19-20(26)14(10-28-21(13)19)12-4-6-18(27-2)16(24)7-12/h3-4,6-8,10,22-25H,5,9H2,1-2H3/b11-3+
- InChIKey
- UCKSAYIMWMIZQJ-QDEBKDIKSA-N
- Compound name
- 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-8-[(E)-4-hydroxy-3-methylbut-2-enyl]chromen-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 385.12818 | 188.9 |
[M+Na]+ | 407.11012 | 197.5 |
[M-H]- | 383.11362 | 193.1 |
[M+NH4]+ | 402.15472 | 198.0 |
[M+K]+ | 423.08406 | 194.1 |
[M+H-H2O]+ | 367.11816 | 180.9 |
[M+HCOO]- | 429.11910 | 204.0 |
[M+CH3COO]- | 443.13475 | 214.9 |
[M+Na-2H]- | 405.09557 | 189.6 |
[M]+ | 384.12035 | 193.3 |
[M]- | 384.12145 | 193.3 |
Literature stripe
Patent stripe
No patent data available for this compound.