![NEOALSOSIDE-D1;20S-PROTOPANAXADIOL-OXIDE-II-3-O-[ALPHA-L-GLUCOPYRANOSYL-(1->3)]-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]](/api/spectrum/FTFNUQvRreS/structure.png?h=300&w=458 "NEOALSOSIDE-D1;20S-PROTOPANAXADIOL-OXIDE-II-3-O-[ALPHA-L-GLUCOPYRANOSYL-(1->3)]-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]")
| SpectraBase Compound ID | FXPYjiMWBlB |
|---|---|
| InChI | InChI=1S/C48H82O17/c1-21-31(51)34(54)36(56)40(59-21)63-38-33(53)25(20-49)61-42(39(38)64-41-37(57)35(55)32(52)22(2)60-41)62-28-13-15-45(7)26(43(28,3)4)12-17-46(8)27(45)19-24(50)30-23(11-16-47(30,46)9)48(10)18-14-29(65-48)44(5,6)58/h21-42,49-58H,11-20H2,1-10H3/t21-,22+,23-,24+,25+,26?,27?,28-,29-,30?,31-,32+,33+,34+,35-,36+,37-,38-,39+,40-,41+,42-,45-,46+,47+,48+/m0/s1 |
| InChIKey | ROKQTNOXBKPLKH-KDTKXYKKSA-N |
| Mol Weight | 931.2 g/mol |
| Molecular Formula | C48H82O17 |
| Exact Mass | 930.555201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FTFNUQvRreS |
|---|---|
| Name | NEOALSOSIDE-D1;20S-PROTOPANAXADIOL-OXIDE-II-3-O-[ALPHA-L-GLUCOPYRANOSYL-(1->3)]-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE] |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H82O17 |
| InChI | InChI=1S/C48H82O17/c1-21-31(51)34(54)36(56)40(59-21)63-38-33(53)25(20-49)61-42(39(38)64-41-37(57)35(55)32(52)22(2)60-41)62-28-13-15-45(7)26(43(28,3)4)12-17-46(8)27(45)19-24(50)30-23(11-16-47(30,46)9)48(10)18-14-29(65-48)44(5,6)58/h21-42,49-58H,11-20H2,1-10H3/t21-,22+,23-,24+,25+,26?,27?,28-,29-,30?,31-,32+,33+,34+,35-,36+,37-,38-,39+,40-,41+,42-,45-,46+,47+,48+/m0/s1 |
| InChIKey | ROKQTNOXBKPLKH-KDTKXYKKSA-N |
| Literature Reference Author | S.FUJITA,R.KASAI,K.OHTANI,K.YAMASAKI,M.H.CHIU,R.L.NIE,O.TANA KA |
| Literature Reference Citation | PHYTOCHEM.,38,465(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00608-V |
| Molecular Weight | 931.169 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4795 |