| SpectraBase Compound ID | 1Y6mbAJPCW6 |
|---|---|
| InChI | InChI=1S/C28H26O7/c1-32-23-14-24-25(27-26(23)21(31)13-22(34-27)16-5-9-18(30)10-6-16)20-12-19(33-28(20)35-24)11-4-15-2-7-17(29)8-3-15/h2-3,5-10,14,19-20,22,28-30H,4,11-13H2,1H3/t19-,20-,22?,28+/m0/s1 |
| InChIKey | JKOQQSVLZXLHME-BGNPVGGSSA-N |
| Mol Weight | 474.51 g/mol |
| Molecular Formula | C28H26O7 |
| Exact Mass | 474.167853 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4HhxqKV1OjV |
|---|---|
| Name | NEOCALYXIN-B |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H26O7 |
| InChI | InChI=1S/C28H26O7/c1-32-23-14-24-25(27-26(23)21(31)13-22(34-27)16-5-9-18(30)10-6-16)20-12-19(33-28(20)35-24)11-4-15-2-7-17(29)8-3-15/h2-3,5-10,14,19-20,22,28-30H,4,11-13H2,1H3/t19-,20-,22?,28+/m0/s1 |
| InChIKey | JKOQQSVLZXLHME-BGNPVGGSSA-N |
| Literature Reference Author | Y.TEZUKA,M.B.GEWALI,M.S.ALI,A.H.BANSKOTA,S.KADOTA |
| Literature Reference Citation | J.NAT.PROD.,64,208(2001) |
| Literature Reference DOI | 10.1021/np000492t |
| Molecular Weight | 474.510 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU3869 |