![3-[(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-OXY]-SITOSTEROL](/api/spectrum/ED5arEwCbD7/structure.png?h=300&w=458 "3-[(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-OXY]-SITOSTEROL")
| SpectraBase Compound ID | 83GAtjmAOr2 |
|---|---|
| InChI | InChI=1S/C63H84O6/c1-7-50(44(2)3)29-28-45(4)54-32-33-55-53-31-30-51-38-52(34-36-62(51,5)56(53)35-37-63(54,55)6)68-61-60(67-42-49-26-18-11-19-27-49)59(66-41-48-24-16-10-17-25-48)58(65-40-47-22-14-9-15-23-47)57(69-61)43-64-39-46-20-12-8-13-21-46/h8-27,30,44-45,50,52-61H,7,28-29,31-43H2,1-6H3/t45-,50+,52+,53+,54-,55+,56+,57-,58-,59+,60-,61-,62+,63-/m1/s1 |
| InChIKey | FRKNWZCUWPRCPP-BPCATCQFSA-N |
| Mol Weight | 937.4 g/mol |
| Molecular Formula | C63H84O6 |
| Exact Mass | 936.62679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ED5arEwCbD7 |
|---|---|
| Name | 3-[(2,3,4,6-TETRA-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-OXY]-SITOSTEROL |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C63H84O6 |
| InChI | InChI=1S/C63H84O6/c1-7-50(44(2)3)29-28-45(4)54-32-33-55-53-31-30-51-38-52(34-36-62(51,5)56(53)35-37-63(54,55)6)68-61-60(67-42-49-26-18-11-19-27-49)59(66-41-48-24-16-10-17-25-48)58(65-40-47-22-14-9-15-23-47)57(69-61)43-64-39-46-20-12-8-13-21-46/h8-27,30,44-45,50,52-61H,7,28-29,31-43H2,1-6H3/t45-,50+,52+,53+,54-,55+,56+,57-,58-,59+,60-,61-,62+,63-/m1/s1 |
| InChIKey | FRKNWZCUWPRCPP-BPCATCQFSA-N |
| Literature Reference Author | T.HASHIMOTO,M.TORI,Y.ASAKAWA |
| Literature Reference Citation | PHYTOCHEM.,30,2927(1991) |
| Literature Reference DOI | 10.1016/S0031-9422(00)98226-8 |
| Molecular Weight | 937.356 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN30947 |