| SpectraBase Compound ID | 2twmQxuQ5hG |
|---|---|
| InChI | InChI=1S/C59H96O27/c1-23-11-16-59(53(75)86-52-46(85-50-42(72)37(67)33(63)24(2)79-50)40(70)36(66)29(82-52)22-78-48-41(71)38(68)34(64)27(19-60)80-48)18-17-56(6)25(47(59)58(23,8)76)9-10-31-55(5)14-13-32(54(3,4)30(55)12-15-57(31,56)7)83-49-44(74)45(26(62)21-77-49)84-51-43(73)39(69)35(65)28(20-61)81-51/h9,23-24,26-52,60-74,76H,10-22H2,1-8H3/t23-,24-,26-,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-,55-,56+,57+,58+,59-/m0/s1 |
| InChIKey | GMQPXRFFFZAJOW-VMAZQFMWSA-N |
| Mol Weight | 1237.4 g/mol |
| Molecular Formula | C59H96O27 |
| Exact Mass | 1236.613898 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LluXVq2bxF7 |
|---|---|
| Name | #4;ILEXOSIDE-XII;3-BETA-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-ARABINOPYRANOSYL-(30S)-19-ALPHA-HYDROXY-URS-12-EN-28-OIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1-> |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H96O27 |
| InChI | InChI=1S/C59H96O27/c1-23-11-16-59(53(75)86-52-46(85-50-42(72)37(67)33(63)24(2)79-50)40(70)36(66)29(82-52)22-78-48-41(71)38(68)34(64)27(19-60)80-48)18-17-56(6)25(47(59)58(23,8)76)9-10-31-55(5)14-13-32(54(3,4)30(55)12-15-57(31,56)7)83-49-44(74)45(26(62)21-77-49)84-51-43(73)39(69)35(65)28(20-61)81-51/h9,23-24,26-52,60-74,76H,10-22H2,1-8H3/t23-,24-,26-,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-,55-,56+,57+,58+,59-/m0/s1 |
| InChIKey | GMQPXRFFFZAJOW-VMAZQFMWSA-N |
| Literature Reference Author | T.KAKUNO,K.YSHIKAWA,S.ARIHARA |
| Literature Reference Citation | PHYTOCHEM.,31,3553(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83726-F |
| Molecular Weight | 1237.395 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS27130 |