| SpectraBase Compound ID | GBRSygJIKih |
|---|---|
| InChI | InChI=1S/C38H42O7/c39-30-13-2-25(3-14-30)1-10-29(23-34(43)19-8-26-4-15-31(40)16-5-26)37-36(44)24-35(22-9-27-6-17-32(41)18-7-27)45-38(37)28-11-20-33(42)21-12-28/h1-7,10-18,20-21,29,34-44H,8-9,19,22-24H2/b10-1+/t29-,34+,35+,36+,37+,38-/m1/s1 |
| InChIKey | OCGXHNIZNJTINO-XKXZSYDMSA-N |
| Mol Weight | 610.7 g/mol |
| Molecular Formula | C38H42O7 |
| Exact Mass | 610.293054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FcqMzKitV3k |
|---|---|
| Name | BLEPHAROCALYXIN-C;7-(1,7-BIS-(4-HYDROXYPHENYL)-5-HYDROXY-1-HEPTENYL)-5-HYDROXY-4''-DE-O-METHYLCENTROLOBIN |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H42O7 |
| InChI | InChI=1S/C38H42O7/c39-30-13-2-25(3-14-30)1-10-29(23-34(43)19-8-26-4-15-31(40)16-5-26)37-36(44)24-35(22-9-27-6-17-32(41)18-7-27)45-38(37)28-11-20-33(42)21-12-28/h1-7,10-18,20-21,29,34-44H,8-9,19,22-24H2/b10-1+/t29-,34+,35+,36+,37+,38-/m1/s1 |
| InChIKey | OCGXHNIZNJTINO-XKXZSYDMSA-N |
| Literature Reference Author | M.S.ALI,Y.TEZUKA,A.H.BANSKOTA,S.KADOTA |
| Literature Reference Citation | J.NAT.PROD.,64,491(2001) |
| Literature Reference DOI | 10.1021/np000493l |
| Molecular Weight | 610.747 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU9365 |