![#1;(25R)-26-[(ALPHA-L-RHAMNOPYRANOSYL)-OXY]-22-ALPHA-METHOXYFUROST-5-EN-3-BETA-YL-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[6-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->3)]-O-BE](/api/spectrum/85EENjWV4gQ/structure.png?h=300&w=458 "#1;(25R)-26-[(ALPHA-L-RHAMNOPYRANOSYL)-OXY]-22-ALPHA-METHOXYFUROST-5-EN-3-BETA-YL-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[6-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->3)]-O-BE")
| SpectraBase Compound ID | 433ALO8WfK8 |
|---|---|
| InChI | InChI=1S/C54H88O24/c1-22(20-70-48-42(64)40(62)36(58)24(3)71-48)10-15-54(68-7)23(2)35-31(78-54)17-30-28-9-8-26-16-27(11-13-52(26,5)29(28)12-14-53(30,35)6)72-50-44(66)46(38(60)33(19-56)74-50)77-51-45(67)47(39(61)34(75-51)21-69-25(4)57)76-49-43(65)41(63)37(59)32(18-55)73-49/h8,22-24,27-51,55-56,58-67H,9-21H2,1-7H3/t22-,23+,24+,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+,53+,54-/m1/s1 |
| InChIKey | YWTWKBDDKZZCIH-MICXTCPSSA-N |
| Mol Weight | 1121.3 g/mol |
| Molecular Formula | C54H88O24 |
| Exact Mass | 1120.566554 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 85EENjWV4gQ |
|---|---|
| Name | #1;(25R)-26-[(ALPHA-L-RHAMNOPYRANOSYL)-OXY]-22-ALPHA-METHOXYFUROST-5-EN-3-BETA-YL-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[6-ACETYL-BETA-D-GLUCOPYRANOSYL-(1->3)]-O-BE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H88O24 |
| InChI | InChI=1S/C54H88O24/c1-22(20-70-48-42(64)40(62)36(58)24(3)71-48)10-15-54(68-7)23(2)35-31(78-54)17-30-28-9-8-26-16-27(11-13-52(26,5)29(28)12-14-53(30,35)6)72-50-44(66)46(38(60)33(19-56)74-50)77-51-45(67)47(39(61)34(75-51)21-69-25(4)57)76-49-43(65)41(63)37(59)32(18-55)73-49/h8,22-24,27-51,55-56,58-67H,9-21H2,1-7H3/t22-,23+,24+,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+,53+,54-/m1/s1 |
| InChIKey | YWTWKBDDKZZCIH-MICXTCPSSA-N |
| Literature Reference Author | A.BRACA,J.M.PRIETO,N.D.TOMMASI,F.TOME,I.MORELLI |
| Literature Reference Citation | PHYTOCHEM.,65,2921(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2004.07.013 |
| Molecular Weight | 1121.278 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN30077 |