| SpectraBase Compound ID | BC4mBNWfIdg |
|---|---|
| InChI | InChI=1S/C51H86N2O16/c1-33(16-34(2)17-50(67)53-48(49(69-3)30-51(53)68)18-35-13-9-7-10-14-35)12-8-5-4-6-11-15-36(55)19-37(56)20-38(57)21-39(58)22-40(59)23-41(60)24-42(61)25-43(62)26-44(63)27-45(64)28-46(65)29-47(66)31-52-32-54/h7,9-10,13-14,17,30,32-33,36-48,55-66H,4-6,8,11-12,15-16,18-29,31H2,1-3H3,(H,52,54)/b34-17-/t33?,36-,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47-,48+/m1/s1 |
| InChIKey | MHPAWKVOZSWSIY-RPSDQIJVSA-N |
| Mol Weight | 983.2 g/mol |
| Molecular Formula | C51H86N2O16 |
| Exact Mass | 982.597735 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HB1kteJbo8r |
|---|---|
| Name | MYCAPOLYOL-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H86N2O16 |
| InChI | InChI=1S/C51H86N2O16/c1-33(16-34(2)17-50(67)53-48(49(69-3)30-51(53)68)18-35-13-9-7-10-14-35)12-8-5-4-6-11-15-36(55)19-37(56)20-38(57)21-39(58)22-40(59)23-41(60)24-42(61)25-43(62)26-44(63)27-45(64)28-46(65)29-47(66)31-52-32-54/h7,9-10,13-14,17,30,32-33,36-48,55-66H,4-6,8,11-12,15-16,18-29,31H2,1-3H3,(H,52,54)/b34-17-/t33?,36-,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47-,48+/m1/s1 |
| InChIKey | MHPAWKVOZSWSIY-RPSDQIJVSA-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 | 983.248 g/mol |
| Sample ID | 42886 |
| Solvent | DMSO-D6 |