![#6;25S-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA,6-BETA-TRIOL-3-O-[O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[3-O-ACETYL-BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1](/api/spectrum/C6eYajPoe6D/structure.png?h=300&w=458 "#6;25S-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA,6-BETA-TRIOL-3-O-[O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[3-O-ACETYL-BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1")
| SpectraBase Compound ID | GbzU4ej4z5s |
|---|---|
| InChI | InChI=1S/C52H84O25/c1-19-6-9-52(68-17-19)20(2)34-30(77-52)11-24-22-10-26(57)25-12-29(27(58)13-51(25,5)23(22)7-8-50(24,34)4)70-47-40(65)38(63)43(33(16-55)73-47)74-49-45(76-48-39(64)37(62)35(60)31(14-53)71-48)44(36(61)32(15-54)72-49)75-46-41(66)42(69-21(3)56)28(59)18-67-46/h19-20,22-49,53-55,57-66H,6-18H2,1-5H3/t19-,20-,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-,51+,52+/m0/s1 |
| InChIKey | IOKIFZKLODFUAY-NYANHVACSA-N |
| Mol Weight | 1109.2 g/mol |
| Molecular Formula | C52H84O25 |
| Exact Mass | 1108.530168 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C6eYajPoe6D |
|---|---|
| Name | #6;25S-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA,6-BETA-TRIOL-3-O-[O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[3-O-ACETYL-BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H84O25 |
| InChI | InChI=1S/C52H84O25/c1-19-6-9-52(68-17-19)20(2)34-30(77-52)11-24-22-10-26(57)25-12-29(27(58)13-51(25,5)23(22)7-8-50(24,34)4)70-47-40(65)38(63)43(33(16-55)73-47)74-49-45(76-48-39(64)37(62)35(60)31(14-53)71-48)44(36(61)32(15-54)72-49)75-46-41(66)42(69-21(3)56)28(59)18-67-46/h19-20,22-49,53-55,57-66H,6-18H2,1-5H3/t19-,20-,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-,51+,52+/m0/s1 |
| InChIKey | IOKIFZKLODFUAY-NYANHVACSA-N |
| Literature Reference Author | Y.MIMAKI,K.KAWASHIMA,T.KANMOTO,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,34,799(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85362-U |
| Molecular Weight | 1109.224 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN6684 |