![(25R)-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA,6-ALPHA-TRIOL3-O-(O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-](/api/spectrum/FFwbX3BWdLI/structure.png?h=300&w=458 "(25R)-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA,6-ALPHA-TRIOL3-O-(O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-")
| SpectraBase Compound ID | 9VLBwe3affq |
|---|---|
| InChI | InChI=1S/C50H82O24/c1-18-5-8-50(66-16-18)19(2)32-28(74-50)10-22-20-9-24(54)23-11-27(25(55)12-49(23,4)21(20)6-7-48(22,32)3)67-45-40(64)37(61)41(31(15-53)70-45)71-47-43(73-46-39(63)36(60)34(58)29(13-51)68-46)42(35(59)30(14-52)69-47)72-44-38(62)33(57)26(56)17-65-44/h18-47,51-64H,5-17H2,1-4H3/t18-,19-,20?,21?,22?,23+,24-,25+,26-,27+,28?,29+,30+,31-,32?,33+,34+,35+,36-,37-,38-,39+,40-,41+,42-,43+,44+,45-,46-,47-,48-,49+,50+/m0/s1 |
| InChIKey | REIZDYUGEPBIJP-ZZSLCWPJSA-N |
| Mol Weight | 1067.2 g/mol |
| Molecular Formula | C50H82O24 |
| Exact Mass | 1066.519603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FFwbX3BWdLI |
|---|---|
| Name | (25R)-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA,6-ALPHA-TRIOL3-O-(O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D- |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H82O24 |
| InChI | InChI=1S/C50H82O24/c1-18-5-8-50(66-16-18)19(2)32-28(74-50)10-22-20-9-24(54)23-11-27(25(55)12-49(23,4)21(20)6-7-48(22,32)3)67-45-40(64)37(61)41(31(15-53)70-45)71-47-43(73-46-39(63)36(60)34(58)29(13-51)68-46)42(35(59)30(14-52)69-47)72-44-38(62)33(57)26(56)17-65-44/h18-47,51-64H,5-17H2,1-4H3/t18-,19-,20?,21?,22?,23+,24-,25+,26-,27+,28?,29+,30+,31-,32?,33+,34+,35+,36-,37-,38-,39+,40-,41+,42-,43+,44+,45-,46-,47-,48-,49+,50+/m0/s1 |
| InChIKey | REIZDYUGEPBIJP-ZZSLCWPJSA-N |
| Literature Reference Author | Y.MIMAKI,M.KURODA,T.FUKASAWA,Y.SASHIDA |
| Literature Reference Citation | J.NAT.PROD.,62,194(1999) |
| Literature Reference DOI | 10.1021/np980346b |
| Molecular Weight | 1067.187 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS19843 |