![OREADOSIDE_A;9-HYDROXYMEGASTIGMA-4-EN-3-ONE_BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GALACTOPYRANOSIDE](/api/spectrum/IM2GanrOFJu/structure.png?h=300&w=458 "OREADOSIDE_A;9-HYDROXYMEGASTIGMA-4-EN-3-ONE_BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GALACTOPYRANOSIDE")
| SpectraBase Compound ID | 8mRNF79JReZ |
|---|---|
| InChI | InChI=1S/C30H50O16/c1-12-7-14(32)8-30(3,4)15(12)6-5-13(2)43-29-26(46-28-25(40)22(37)20(35)17(9-31)44-28)23(38)21(36)18(45-29)11-42-27-24(39)19(34)16(33)10-41-27/h7,13,15-29,31,33-40H,5-6,8-11H2,1-4H3/t13-,15-,16-,17+,18+,19+,20-,21+,22-,23-,24-,25+,26+,27+,28-,29+/m0/s1 |
| InChIKey | FLWWWXDRORWMEK-XMTBYKIISA-N |
| Mol Weight | 666.7 g/mol |
| Molecular Formula | C30H50O16 |
| Exact Mass | 666.309886 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IM2GanrOFJu |
|---|---|
| Name | OREADOSIDE_A;9-HYDROXYMEGASTIGMA-4-EN-3-ONE_BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O16 |
| InChI | InChI=1S/C30H50O16/c1-12-7-14(32)8-30(3,4)15(12)6-5-13(2)43-29-26(46-28-25(40)22(37)20(35)17(9-31)44-28)23(38)21(36)18(45-29)11-42-27-24(39)19(34)16(33)10-41-27/h7,13,15-29,31,33-40H,5-6,8-11H2,1-4H3/t13-,15-,16-,17+,18+,19+,20-,21+,22-,23-,24-,25+,26+,27+,28-,29+/m0/s1 |
| InChIKey | FLWWWXDRORWMEK-XMTBYKIISA-N |
| Literature Reference Author | J.J.ARAYA,K.KINDSCHER,B.N.TIMMERMANN |
| Literature Reference Citation | J.NAT.PROD.,75,400(2012) |
| Literature Reference DOI | 10.1021/np2008076 |
| Molecular Weight | 666.717 g/mol |
| Sample ID | 40147 |
| Solvent | C5D5N |