| SpectraBase Compound ID | Hr40eQUASVv |
|---|---|
| InChI | InChI=1S/C34H42O21S/c1-56-34(46)49-7-11-3-15-21-13(28(44)50-15)9-48-31(19(11)21)55-33-26(43)27(23(40)17(6-37)52-33)53-29(45)12-8-47-30(18-10(4-35)2-14(38)20(12)18)54-32-25(42)24(41)22(39)16(5-36)51-32/h2-3,8-9,14-27,30-33,35-43H,4-7H2,1H3/t14-,15-,16-,17+,18?,19?,20?,21?,22-,23+,24+,25-,26+,27-,30-,31-,32+,33-/m0/s1 |
| InChIKey | SSONCXFOGTVDNE-BYUSZFABSA-N |
| Mol Weight | 818.7 g/mol |
| Molecular Formula | C34H42O21S |
| Exact Mass | 818.19393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3rOjg2FLGsb |
|---|---|
| Name | SAPROSMOSIDE-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H42O21S |
| InChI | InChI=1S/C34H42O21S/c1-56-34(46)49-7-11-3-15-21-13(28(44)50-15)9-48-31(19(11)21)55-33-26(43)27(23(40)17(6-37)52-33)53-29(45)12-8-47-30(18-10(4-35)2-14(38)20(12)18)54-32-25(42)24(41)22(39)16(5-36)51-32/h2-3,8-9,14-27,30-33,35-43H,4-7H2,1H3/t14-,15-,16-,17+,18?,19?,20?,21?,22-,23+,24+,25-,26+,27-,30-,31-,32+,33-/m0/s1 |
| InChIKey | SSONCXFOGTVDNE-BYUSZFABSA-N |
| Literature Reference Author | S.K.LING,A.KOMORITA,T.TANAKA,T.FUJIOKA,K.MIHASHI,I.KOUNO |
| Literature Reference Citation | J.NAT.PROD.,65,656(2002) |
| Literature Reference DOI | 10.1021/np010479o |
| Molecular Weight | 818.755 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI4147 |