| SpectraBase Compound ID | CRhVYSYIv7u |
|---|---|
| InChI | InChI=1S/C49H82N2O15/c1-32(16-33(2)17-48(64)51-46(47(66-3)29-49(51)65)18-34-13-9-7-10-14-34)12-8-5-4-6-11-15-35(53)19-36(54)20-37(55)21-38(56)22-39(57)23-40(58)24-41(59)25-42(60)26-43(61)27-44(62)28-45(63)30-50-31-52/h7,9-10,13-14,17,29,31-32,35-46,53-63H,4-6,8,11-12,15-16,18-28,30H2,1-3H3,(H,50,52)/b33-17-/t32?,35-,36+,37+,38+,39+,40+,41+,42+,43+,44+,45-,46+/m1/s1 |
| InChIKey | ZKEFPANIBGVJQY-PKDUXAQZSA-N |
| Mol Weight | 939.2 g/mol |
| Molecular Formula | C49H82N2O15 |
| Exact Mass | 938.57152 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7qXAmRkYOpd |
|---|---|
| Name | MYCAPOLYOL-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H82N2O15 |
| InChI | InChI=1S/C49H82N2O15/c1-32(16-33(2)17-48(64)51-46(47(66-3)29-49(51)65)18-34-13-9-7-10-14-34)12-8-5-4-6-11-15-35(53)19-36(54)20-37(55)21-38(56)22-39(57)23-40(58)24-41(59)25-42(60)26-43(61)27-44(62)28-45(63)30-50-31-52/h7,9-10,13-14,17,29,31-32,35-46,53-63H,4-6,8,11-12,15-16,18-28,30H2,1-3H3,(H,50,52)/b33-17-/t32?,35-,36+,37+,38+,39+,40+,41+,42+,43+,44+,45-,46+/m1/s1 |
| InChIKey | ZKEFPANIBGVJQY-PKDUXAQZSA-N |
| Literature Reference Author | P.PHUWAPRAISIRISAN,S.MATSUNAGA,N.FUSETANI |
| Literature Reference Citation | ORG.LETTERS,7,2233(2005) |
| Literature Reference DOI | 10.1021/ol050648m |
| Molecular Weight | 939.194 g/mol |
| Sample ID | 42887 |
| Solvent | DMSO-D6 |