| SpectraBase Compound ID | JcnBCF6QdeH |
|---|---|
| InChI | InChI=1S/C46H72O12/c1-12-24(3)38(53)56-34-26(5)55-40(33(51)35(34)57-39(54)25(4)13-2)58-37-36(52)46(23-48)28(20-41(37,6)7)27-14-15-30-42(8)18-17-31(49)43(9,22-47)29(42)16-19-44(30,10)45(27,11)21-32(46)50/h12-14,26,28-37,40,47-52H,15-23H2,1-11H3/b24-12-,25-13-/t26-,28?,29?,30?,31+,32-,33-,34+,35-,36+,37+,40+,42+,43-,44-,45-,46+/m1/s1 |
| InChIKey | AKKIXIYYMOHCOW-CQADOAGGSA-N |
| Mol Weight | 817.1 g/mol |
| Molecular Formula | C46H72O12 |
| Exact Mass | 816.502378 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CR6niecSPMS |
|---|---|
| Name | NAPOLEOGENIN-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H72O12 |
| InChI | InChI=1S/C46H72O12/c1-12-24(3)38(53)56-34-26(5)55-40(33(51)35(34)57-39(54)25(4)13-2)58-37-36(52)46(23-48)28(20-41(37,6)7)27-14-15-30-42(8)18-17-31(49)43(9,22-47)29(42)16-19-44(30,10)45(27,11)21-32(46)50/h12-14,26,28-37,40,47-52H,15-23H2,1-11H3/b24-12-,25-13-/t26-,28?,29?,30?,31+,32-,33-,34+,35-,36+,37+,40+,42+,43-,44-,45-,46+/m1/s1 |
| InChIKey | AKKIXIYYMOHCOW-CQADOAGGSA-N |
| Literature Reference Author | Y.CHEN,T.TAKEDA,Y.OGIHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,33,1043(1985) |
| Literature Reference DOI | 10.1248/cpb.33.1043 |
| Molecular Weight | 817.070 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK51 |