| SpectraBase Compound ID | kXuJke6kKu |
|---|---|
| InChI | InChI=1S/C22H32O4.Na/c1-17(9-5-11-19(3)15-21(23)22(24)25)7-4-8-18(2)10-6-12-20-13-14-26-16-20;/h4,7-8,11,13-14,16-17,21,23H,5-6,9-10,12,15H2,1-3H3,(H,24,25);/q;+1/p-1/b7-4+,18-8+,19-11+;/t17-,21?;/m1./s1 |
| InChIKey | UNRMHKZMQXKKAP-WXMZAFFISA-M |
| Mol Weight | 382.48 g/mol |
| Molecular Formula | C22H31NaO4 |
| Exact Mass | 382.212004 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9NKdGIhK6cM |
|---|---|
| Name | SARCOTIN-I |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H31NaO4 |
| InChI | InChI=1S/C22H32O4.Na/c1-17(9-5-11-19(3)15-21(23)22(24)25)7-4-8-18(2)10-6-12-20-13-14-26-16-20;/h4,7-8,11,13-14,16-17,21,23H,5-6,9-10,12,15H2,1-3H3,(H,24,25);/q;+1/p-1/b7-4+,18-8+,19-11+;/t17-,21?;/m1./s1 |
| InChIKey | UNRMHKZMQXKKAP-WXMZAFFISA-M |
| Literature Reference Author | Y.LIU,J.HONG,C.O.LEE,K.S.IM,N.D.KIM,J.S.CHOI,J.H.JUNG |
| Literature Reference Citation | J.NAT.PROD.,65,1307(2002) |
| Literature Reference DOI | 10.1021/np020145e |
| Molecular Weight | 382.476 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI5214 |