| SpectraBase Compound ID | GOTVyF11rjA |
|---|---|
| InChI | InChI=1S/C45H68O13/c1-32(47)50-19-18-35(51-30-48-28-33-14-10-8-11-15-33)20-37-23-40(56-43(2,3)53-37)25-41-24-38(54-44(4,5)57-41)21-36(52-31-49-29-34-16-12-9-13-17-34)22-39-26-42(27-46)58-45(6,7)55-39/h8-17,35-42,46H,18-31H2,1-7H3/t35-,36-,37-,38+,39-,40-,41-,42-/m0/s1 |
| InChIKey | MOUSCBMYKYYCFI-YVQQOERGSA-N |
| Mol Weight | 817.0 g/mol |
| Molecular Formula | C45H68O13 |
| Exact Mass | 816.465992 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ctsw0Esl6u |
|---|---|
| Name | MOUSCBMYKYYCFI-YVQQOERGSA-N |
| Compound Number | 31 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H68O13 |
| InChI | InChI=1S/C45H68O13/c1-32(47)50-19-18-35(51-30-48-28-33-14-10-8-11-15-33)20-37-23-40(56-43(2,3)53-37)25-41-24-38(54-44(4,5)57-41)21-36(52-31-49-29-34-16-12-9-13-17-34)22-39-26-42(27-46)58-45(6,7)55-39/h8-17,35-42,46H,18-31H2,1-7H3/t35-,36-,37-,38+,39-,40-,41-,42-/m0/s1 |
| InChIKey | MOUSCBMYKYYCFI-YVQQOERGSA-N |
| Literature Reference Author | S.GERBER-LEMAIRE,A.T.CARMONA,K.T.MEILERT,P.VOGEL |
| Literature Reference Citation | EUR.J.ORG.CHEM.,891(2006) |
| Molecular Weight | 817.027 g/mol |
| Sample ID | 43633 |
| Solvent | CD3OD |