| SpectraBase Compound ID | KvvfZpAChPA |
|---|---|
| InChI | InChI=1S/C35H54O9/c1-30(2)13-15-35(29(41)42)16-14-32(4)19(20(35)17-30)7-8-22-31(3)11-10-24(44-27-26(38)25(37)21(36)18-43-27)34(6,28(39)40)23(31)9-12-33(22,32)5/h7,20-27,36-38H,8-18H2,1-6H3,(H,39,40)(H,41,42)/t20?,21-,22?,23?,24-,25-,26+,27-,31+,32+,33+,34-,35-/m0/s1 |
| InChIKey | DXJCPZYEMVPDFE-INYUMEMMSA-N |
| Mol Weight | 618.8 g/mol |
| Molecular Formula | C35H54O9 |
| Exact Mass | 618.376783 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gv0lrxwAgfx |
|---|---|
| Name | CHIONAEOSIDE_D;3-O-ALPHA-L-ARABINOPYRANOSYLGYPSOGENIC_ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O9 |
| InChI | InChI=1S/C35H54O9/c1-30(2)13-15-35(29(41)42)16-14-32(4)19(20(35)17-30)7-8-22-31(3)11-10-24(44-27-26(38)25(37)21(36)18-43-27)34(6,28(39)40)23(31)9-12-33(22,32)5/h7,20-27,36-38H,8-18H2,1-6H3,(H,39,40)(H,41,42)/t20?,21-,22?,23?,24-,25-,26+,27-,31+,32+,33+,34-,35-/m0/s1 |
| InChIKey | DXJCPZYEMVPDFE-INYUMEMMSA-N |
| Literature Reference Author | S.AVUNDUK,M.A.LACAILLE-DUBOIS,T.MIYAMOTO,E.BEDIR,S.G.SENOL,O .A.CALISKAN |
| Literature Reference Citation | J.NAT.PROD.,70,1830(2007) |
| Literature Reference DOI | 10.1021/np0704607 |
| Molecular Weight | 618.808 g/mol |
| Sample ID | 31104 |
| Solvent | C5D5N |