CID 14132199
Riccardin d
Structural Information
- Molecular Formula
- C28H24O4
- SMILES
- C1CC2=C(C3=C(C=C(CCC4=CC(=C(C=C4)O)OC5=CC=C1C=C5)C=C3)O)C(=CC=C2)O
- InChI
- InChI=1S/C28H24O4/c29-24-15-10-20-5-4-19-9-14-23(26(31)16-19)28-21(2-1-3-25(28)30)11-6-18-7-12-22(13-8-18)32-27(24)17-20/h1-3,7-10,12-17,29-31H,4-6,11H2
- InChIKey
- CAILVWNDCKNABC-UHFFFAOYSA-N
- Compound name
- 14-oxapentacyclo[20.2.2.210,13.115,19.02,7]nonacosa-1(24),2(7),3,5,10(29),11,13(28),15,17,19(27),22,25-dodecaene-3,16,24-triol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 425.17473 | 199.6 |
[M+Na]+ | 447.15667 | 193.8 |
[M-H]- | 423.16017 | 180.7 |
[M+NH4]+ | 442.20127 | 204.1 |
[M+K]+ | 463.13061 | 196.2 |
[M+H-H2O]+ | 407.16471 | 198.6 |
[M+HCOO]- | 469.16565 | 191.9 |
[M+CH3COO]- | 483.18130 | 196.7 |
[M+Na-2H]- | 445.14212 | 205.3 |
[M]+ | 424.16690 | 195.9 |
[M]- | 424.16800 | 195.9 |