![#6;PHYSENOSIDE-S6;28-O-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[[BETA-D-APIO-D-FURANOSYL-(1->3)]-4-O-(9-OXO-16-BETA-[(D-XYLOPYRANOSYL)-OXY]-](/api/spectrum/mg4RcDnycL/structure.png?h=300&w=458 "#6;PHYSENOSIDE-S6;28-O-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[[BETA-D-APIO-D-FURANOSYL-(1->3)]-4-O-(9-OXO-16-BETA-[(D-XYLOPYRANOSYL)-OXY]-")
| SpectraBase Compound ID | C1egJVFQc7D |
|---|---|
| InChI | InChI=1S/C78H128O33/c1-39-60(107-66-57(93)52(88)45(85)34-101-66)55(91)59(95)67(104-39)109-62-61(108-70-63(96)78(98,37-81)38-103-70)47(105-50(86)20-16-12-8-10-14-18-40(82)19-15-11-9-13-17-29-99-65-56(92)51(87)44(84)33-100-65)35-102-69(62)111-71(97)77-27-25-72(2,3)30-42(77)41-21-22-49-73(4)31-43(83)64(110-68-58(94)54(90)53(89)46(32-79)106-68)74(5,36-80)48(73)23-24-76(49,7)75(41,6)26-28-77/h21,39,42-49,51-70,79-81,83-85,87-96,98H,8-20,22-38H2,1-7H3/t39-,42-,43-,44-,45-,46+,47-,48+,49+,51+,52+,53+,54-,55-,56-,57-,58+,59+,60-,61-,62+,63-,64-,65-,66+,67-,68-,69-,70-,73-,74-,75+,76+,77-,78+/m0/s1 |
| InChIKey | SBBJLVYIYDCBPA-UUYRXNFSSA-N |
| Mol Weight | 1593.8 g/mol |
| Molecular Formula | C78H128O33 |
| Exact Mass | 1592.833787 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | mg4RcDnycL |
|---|---|
| Name | #6;PHYSENOSIDE-S6;28-O-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[[BETA-D-APIO-D-FURANOSYL-(1->3)]-4-O-(9-OXO-16-BETA-[(D-XYLOPYRANOSYL)-OXY]- |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C78H128O33 |
| InChI | InChI=1S/C78H128O33/c1-39-60(107-66-57(93)52(88)45(85)34-101-66)55(91)59(95)67(104-39)109-62-61(108-70-63(96)78(98,37-81)38-103-70)47(105-50(86)20-16-12-8-10-14-18-40(82)19-15-11-9-13-17-29-99-65-56(92)51(87)44(84)33-100-65)35-102-69(62)111-71(97)77-27-25-72(2,3)30-42(77)41-21-22-49-73(4)31-43(83)64(110-68-58(94)54(90)53(89)46(32-79)106-68)74(5,36-80)48(73)23-24-76(49,7)75(41,6)26-28-77/h21,39,42-49,51-70,79-81,83-85,87-96,98H,8-20,22-38H2,1-7H3/t39-,42-,43-,44-,45-,46+,47-,48+,49+,51+,52+,53+,54-,55-,56-,57-,58+,59+,60-,61-,62+,63-,64-,65-,66+,67-,68-,69-,70-,73-,74-,75+,76+,77-,78+/m0/s1 |
| InChIKey | SBBJLVYIYDCBPA-UUYRXNFSSA-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 | 1593.855 g/mol |
| Sample ID | 45548 |
| Solvent | C5D5N |