| SpectraBase Compound ID | KSlO0dCI8K8 |
|---|---|
| InChI | InChI=1S/C53H101NO14/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26-29-32-35-42(58)51(64)54-40(41(57)34-31-28-25-22-20-19-21-24-27-30-33-39(3)5-2)38-65-52-49(63)47(61)50(44(37-56)67-52)68-53-48(62)46(60)45(59)43(36-55)66-53/h31,34,39-50,52-53,55-63H,4-30,32-33,35-38H2,1-3H3,(H,54,64)/b34-31+/t39?,40-,41+,42-,43-,44-,45+,46+,47-,48-,49-,50-,52-,53+/m1/s1 |
| InChIKey | RIMJWTASCYXXDS-ZMTIDQEVSA-N |
| Mol Weight | 976.4 g/mol |
| Molecular Formula | C53H101NO14 |
| Exact Mass | 975.722207 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HZdMEu93K8L |
|---|---|
| Name | RIMJWTASCYXXDS-ZMTIDQEVSA-N |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H101NO14 |
| InChI | InChI=1S/C53H101NO14/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26-29-32-35-42(58)51(64)54-40(41(57)34-31-28-25-22-20-19-21-24-27-30-33-39(3)5-2)38-65-52-49(63)47(61)50(44(37-56)67-52)68-53-48(62)46(60)45(59)43(36-55)66-53/h31,34,39-50,52-53,55-63H,4-30,32-33,35-38H2,1-3H3,(H,54,64)/b34-31+/t39?,40-,41+,42-,43-,44-,45+,46+,47-,48-,49-,50-,52-,53+/m1/s1 |
| InChIKey | RIMJWTASCYXXDS-ZMTIDQEVSA-N |
| Literature Reference Author | S.KAWATAKE,M.INAGAKI,R.ISOBE,T.MIYAMOTO,R.HIGUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,1386(2002) |
| Literature Reference DOI | 10.1248/cpb.50.1386 |
| Molecular Weight | 976.383 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS20323 |