![#2;PHYSENOSIDE-S2;28-O-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-APIO-D-FURANOSYL-(1->3)]-ALPHA-L-ARABINOPYRANOSYL-3-O-BETA-D-GLUCOPYR](/api/spectrum/5MUYRrU3qb4/structure.png?h=300&w=458 "#2;PHYSENOSIDE-S2;28-O-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-APIO-D-FURANOSYL-(1->3)]-ALPHA-L-ARABINOPYRANOSYL-3-O-BETA-D-GLUCOPYR")
| SpectraBase Compound ID | 9hS78YEt4sH |
|---|---|
| InChI | InChI=1S/C57H92O26/c1-24-40(79-45-37(68)33(64)28(62)19-74-45)36(67)39(70)46(77-24)81-42-41(80-49-43(71)57(73,22-60)23-76-49)29(63)20-75-48(42)83-50(72)56-14-12-51(2,3)16-26(56)25-8-9-32-52(4)17-27(61)44(82-47-38(69)35(66)34(65)30(18-58)78-47)53(5,21-59)31(52)10-11-55(32,7)54(25,6)13-15-56/h8,24,26-49,58-71,73H,9-23H2,1-7H3/t24-,26-,27-,28-,29-,30+,31+,32+,33+,34+,35-,36-,37-,38+,39+,40-,41-,42+,43+,44-,45+,46-,47-,48-,49+,52-,53-,54+,55+,56-,57-/m0/s1 |
| InChIKey | VCQKLYXPPYUQTG-VDZROGMUSA-N |
| Mol Weight | 1193.3 g/mol |
| Molecular Formula | C57H92O26 |
| Exact Mass | 1192.587683 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5MUYRrU3qb4 |
|---|---|
| Name | #2;PHYSENOSIDE-S2;28-O-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-APIO-D-FURANOSYL-(1->3)]-ALPHA-L-ARABINOPYRANOSYL-3-O-BETA-D-GLUCOPYR |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H92O26 |
| InChI | InChI=1S/C57H92O26/c1-24-40(79-45-37(68)33(64)28(62)19-74-45)36(67)39(70)46(77-24)81-42-41(80-49-43(71)57(73,22-60)23-76-49)29(63)20-75-48(42)83-50(72)56-14-12-51(2,3)16-26(56)25-8-9-32-52(4)17-27(61)44(82-47-38(69)35(66)34(65)30(18-58)78-47)53(5,21-59)31(52)10-11-55(32,7)54(25,6)13-15-56/h8,24,26-49,58-71,73H,9-23H2,1-7H3/t24-,26-,27-,28-,29-,30+,31+,32+,33+,34+,35-,36-,37-,38+,39+,40-,41-,42+,43+,44-,45+,46-,47-,48-,49+,52-,53-,54+,55+,56-,57-/m0/s1 |
| InChIKey | VCQKLYXPPYUQTG-VDZROGMUSA-N |
| Literature Reference Author | M.INOUE,K.OHTANI,R.KASAI,M.OKUKUBO,M.ANDRIANTSIFERANA,K.YAMA SAKI,T.KOIKE |
| Literature Reference Citation | PHYTOCHEM.,70,1195(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.06.002 |
| Molecular Weight | 1193.342 g/mol |
| Sample ID | 45544 |
| Solvent | C5D5N |