| SpectraBase Compound ID | 5OP6k6pDVpP |
|---|---|
| InChI | InChI=1S/C64H104O33/c1-22-34(73)38(77)41(80)53(88-22)93-47-29(71)20-86-52(44(47)83)92-46-23(2)89-54(43(82)40(46)79)95-49-35(74)28(70)19-87-57(49)97-58(85)64-12-11-59(3,4)13-25(64)24-9-10-32-60(5)14-27(69)51(61(6,21-67)50(60)26(68)15-63(32,8)62(24,7)16-33(64)72)96-56-45(84)48(37(76)31(18-66)91-56)94-55-42(81)39(78)36(75)30(17-65)90-55/h9,22-23,25-57,65-84H,10-21H2,1-8H3/t22-,23+,25-,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-,53-,54+,55+,56+,57+,60-,61+,62-,63-,64-/m1/s1 |
| InChIKey | COJCMTPETOWDEC-SYEPMFMESA-N |
| Mol Weight | 1401.5 g/mol |
| Molecular Formula | C64H104O33 |
| Exact Mass | 1400.645986 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F4qiUt55exr |
|---|---|
| Name | #3;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-2-BETA,3-BETA,6-BETA,16-ALPHA,23-PENTAHYDROXY-OLEAN-12-EN-28-OIC-ACID-28-O-ALPHA-L-RHAMNOPYRANOPYRANO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C64H104O33 |
| InChI | InChI=1S/C64H104O33/c1-22-34(73)38(77)41(80)53(88-22)93-47-29(71)20-86-52(44(47)83)92-46-23(2)89-54(43(82)40(46)79)95-49-35(74)28(70)19-87-57(49)97-58(85)64-12-11-59(3,4)13-25(64)24-9-10-32-60(5)14-27(69)51(61(6,21-67)50(60)26(68)15-63(32,8)62(24,7)16-33(64)72)96-56-45(84)48(37(76)31(18-66)91-56)94-55-42(81)39(78)36(75)30(17-65)90-55/h9,22-23,25-57,65-84H,10-21H2,1-8H3/t22-,23+,25-,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-,53-,54+,55+,56+,57+,60-,61+,62-,63-,64-/m1/s1 |
| InChIKey | COJCMTPETOWDEC-SYEPMFMESA-N |
| Literature Reference Author | B.HERNANDEZ-CARLOS,M.CARMONA-PINEDA,C.VILLANUEVA-CANONGO,J.F .LOPEZ-OLGUIN,A.ARAG |
| Literature Reference Citation | MAGN.RES.CHEM.,47,994(2009) |
| Literature Reference DOI | 10.1002/mrc.2487 |
| Molecular Weight | 1401.510 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU80182 |