| SpectraBase Compound ID | 1URMN4UfmsS |
|---|---|
| InChI | InChI=1S/C27H48O9S.Na/c1-15(14-36-37(33,34)35)6-5-7-16(2)21-23(30)24(31)22-18-12-20(29)27(32)13-17(28)8-11-26(27,4)19(18)9-10-25(21,22)3;/h15-24,28-32H,5-14H2,1-4H3,(H,33,34,35);/q;+1/p-1/t15-,16-,17+,18?,19?,20-,21+,22?,23-,24-,25-,26-,27+;/m1./s1 |
| InChIKey | VXYUEPSEJZHMSE-LKDCRAERSA-M |
| Mol Weight | 570.7 g/mol |
| Molecular Formula | C27H47NaO9S |
| Exact Mass | 570.283849 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7HYKtC3rL2y |
|---|---|
| Name | VXYUEPSEJZHMSE-LKDCRAERSA-M |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H47NaO9S |
| InChI | InChI=1S/C27H48O9S.Na/c1-15(14-36-37(33,34)35)6-5-7-16(2)21-23(30)24(31)22-18-12-20(29)27(32)13-17(28)8-11-26(27,4)19(18)9-10-25(21,22)3;/h15-24,28-32H,5-14H2,1-4H3,(H,33,34,35);/q;+1/p-1/t15-,16-,17+,18?,19?,20-,21+,22?,23-,24-,25-,26-,27+;/m1./s1 |
| InChIKey | VXYUEPSEJZHMSE-LKDCRAERSA-M |
| Literature Reference Author | M.IORIZZI,P.BRYAN,J.MCCLINTOCK,L.MINALE,E.PALAGIANO,S.MAUREL LI,R.RICCIO,F.ZOLLO |
| Literature Reference Citation | J.NAT.PROD.,58,653(1995) |
| Literature Reference DOI | 10.1021/np50119a003 |
| Molecular Weight | 570.715 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP4472 |