| SpectraBase Compound ID | EsEaqZzUwjP |
|---|---|
| InChI | InChI=1S/C32H56O12S.Na/c1-16(2)24(43-29-27(37)26(36)23(35)15-42-29)7-6-17(3)19-13-21(33)28-31(19,5)11-9-25-30(4)10-8-18(44-45(39,40)41)12-20(30)22(34)14-32(25,28)38;/h16-29,33-38H,6-15H2,1-5H3,(H,39,40,41);/q;+1/p-1/t17-,18+,19-,20-,21-,22+,23-,24+,25-,26+,27-,28-,29+,30+,31-,32+;/m1./s1 |
| InChIKey | DRZOYOXKWJSRGM-XVWLOIKASA-M |
| Mol Weight | 686.8 g/mol |
| Molecular Formula | C32H55NaO12S |
| Exact Mass | 686.331193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 99mK3r2xKWw |
|---|---|
| Name | PYCNOPODIOSIDE-B |
| CAS Registry Number | 124596-51-6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H55NaO12S |
| InChI | InChI=1S/C32H56O12S.Na/c1-16(2)24(43-29-27(37)26(36)23(35)15-42-29)7-6-17(3)19-13-21(33)28-31(19,5)11-9-25-30(4)10-8-18(44-45(39,40)41)12-20(30)22(34)14-32(25,28)38;/h16-29,33-38H,6-15H2,1-5H3,(H,39,40,41);/q;+1/p-1/t17-,18+,19-,20-,21-,22+,23-,24+,25-,26+,27-,28-,29+,30+,31-,32+;/m1./s1 |
| InChIKey | DRZOYOXKWJSRGM-XVWLOIKASA-M |
| Literature Reference Author | I.BRUNO,L.MINALE,R.RICCIO |
| Literature Reference Citation | J.NAT.PROD.,52,1022(1989) |
| Literature Reference DOI | 10.1021/np50065a017 |
| Molecular Weight | 686.831 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWTS396 |