| SpectraBase Compound ID | 5TeK9lSYYwx |
|---|---|
| InChI | InChI=1S/C66H108O31/c1-25-36(70)53(96-56-45(79)40(74)37(71)29(21-67)89-56)50(84)59(87-25)94-51-26(2)88-54(48(82)43(51)77)86-24-32-39(73)42(76)46(80)57(92-32)95-52-31(23-69)91-55(49(83)44(52)78)93-35-13-14-63(7)33(62(35,5)6)12-15-65(9)34(63)11-10-27-28-20-61(3,4)16-18-66(28,19-17-64(27,65)8)60(85)97-58-47(81)41(75)38(72)30(22-68)90-58/h10,25-26,28-59,67-84H,11-24H2,1-9H3/t25-,26+,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+,58-,59-,63?,64?,65?,66-/m0/s1 |
| InChIKey | CAUKEKSNJJJHGU-CFINZMAFSA-N |
| Mol Weight | 1397.6 g/mol |
| Molecular Formula | C66H108O31 |
| Exact Mass | 1396.687457 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GIOb3bvxTY2 |
|---|---|
| Name | 3-BETA-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRA |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C66H108O31 |
| InChI | InChI=1S/C66H108O31/c1-25-36(70)53(96-56-45(79)40(74)37(71)29(21-67)89-56)50(84)59(87-25)94-51-26(2)88-54(48(82)43(51)77)86-24-32-39(73)42(76)46(80)57(92-32)95-52-31(23-69)91-55(49(83)44(52)78)93-35-13-14-63(7)33(62(35,5)6)12-15-65(9)34(63)11-10-27-28-20-61(3,4)16-18-66(28,19-17-64(27,65)8)60(85)97-58-47(81)41(75)38(72)30(22-68)90-58/h10,25-26,28-59,67-84H,11-24H2,1-9H3/t25-,26+,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+,58-,59-,63?,64?,65?,66-/m0/s1 |
| InChIKey | CAUKEKSNJJJHGU-CFINZMAFSA-N |
| Literature Reference Author | N.D.TOMMASI,C.PIZZA,A.BELLINO,P.VENTURELLA |
| Literature Reference Citation | J.NAT.PROD.,60,1070(1997) |
| Literature Reference DOI | 10.1021/np970263f |
| Molecular Weight | 1397.565 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ11943 |