| SpectraBase Compound ID | 6EEQDwp4wJB |
|---|---|
| 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-OZDQMZIBSA-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 | C8G6W7K1MaM |
|---|---|
| Name | 25R-5alpha-SPIROSTAN-2alpha,3beta,6beta-TRIOL 3-O-beta-D-GLUCOPYRANOSYL-(1-2)-O-(beta-D-XYLOPYRANOSYL-(1-3))-O-beta-D-GLUCOPYRANOSYL-(1-4)-beta-D-GALACTO-PYRANOSIDE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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-OZDQMZIBSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |