| SpectraBase Compound ID | 3W3XVsyFgod |
|---|---|
| InChI | InChI=1S/C41H51N5O11/c1-25(2)18-19-57-31-16-12-29(13-17-31)21-33(41(55)56-4)45-39(53)34(24-47)46-38(52)32(20-28-10-14-30(48)15-11-28)44-36(50)23-42-37(51)26(3)43-40(54)35(49)22-27-8-6-5-7-9-27/h5-18,26,32-35,47-49H,19-24H2,1-4H3,(H,42,51)(H,43,54)(H,44,50)(H,45,53)(H,46,52)/t26-,32+,33+,34+,35-/m0/s1 |
| InChIKey | VJMAOWJFPIPCSB-VSGSCEHBSA-N |
| Mol Weight | 789.9 g/mol |
| Molecular Formula | C41H51N5O11 |
| Exact Mass | 789.358507 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1BXrvkRPdCI |
|---|---|
| Name | CONOIDEOCRELLIDE_C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H51N5O11 |
| InChI | InChI=1S/C41H51N5O11/c1-25(2)18-19-57-31-16-12-29(13-17-31)21-33(41(55)56-4)45-39(53)34(24-47)46-38(52)32(20-28-10-14-30(48)15-11-28)44-36(50)23-42-37(51)26(3)43-40(54)35(49)22-27-8-6-5-7-9-27/h5-18,26,32-35,47-49H,19-24H2,1-4H3,(H,42,51)(H,43,54)(H,44,50)(H,45,53)(H,46,52)/t26-,32+,33+,34+,35-/m0/s1 |
| InChIKey | VJMAOWJFPIPCSB-VSGSCEHBSA-N |
| Literature Reference Author | M.ISAKA,S.PALASARN,S.SUPTHINA,S.KOMWIJIT,J.J.LUANGSAARD |
| Literature Reference Citation | J.NAT.PROD.,74,782(2011) |
| Literature Reference DOI | 10.1021/np100849x |
| Molecular Weight | 789.883 g/mol |
| Sample ID | 37304 |
| Solvent | DMSO-D6 |