![#1;3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-([ALPHA-L-ARABINOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANO](/api/spectrum/AiN336iOPUb/structure.png?h=300&w=458 "#1;3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-([ALPHA-L-ARABINOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANO")
| SpectraBase Compound ID | JkR1E5KAZRy |
|---|---|
| InChI | InChI=1S/C77H120O42/c1-26-54(112-67-58(42(88)33(84)23-104-67)116-68-57(41(87)32(83)24-105-68)114-63-50(96)40(86)31(82)22-103-63)49(95)53(99)64(106-26)118-61-60(117-66-52(98)46(92)44(90)35(21-79)110-66)55(108-28(3)81)27(2)107-70(61)119-71(102)77-17-16-72(4,5)18-30(77)29-10-11-37-73(6)14-13-39(74(7,25-80)36(73)12-15-75(37,8)76(29,9)19-38(77)85)111-69-59(48(94)47(93)56(113-69)62(100)101)115-65-51(97)45(91)43(89)34(20-78)109-65/h10,25-27,30-61,63-70,78-79,82-99H,11-24H2,1-9H3,(H,100,101)/t26-,27+,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+,60-,61+,63+,64-,65-,66-,67+,68+,69+,70-,73-,74-,75+,76+,77+/m0/s1 |
| InChIKey | OATVNTQBPPEYFV-JXMDKODJSA-N |
| Mol Weight | 1717.8 g/mol |
| Molecular Formula | C77H120O42 |
| Exact Mass | 1716.725418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AiN336iOPUb |
|---|---|
| Name | #1;3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-([ALPHA-L-ARABINOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C77H120O42 |
| InChI | InChI=1S/C77H120O42/c1-26-54(112-67-58(42(88)33(84)23-104-67)116-68-57(41(87)32(83)24-105-68)114-63-50(96)40(86)31(82)22-103-63)49(95)53(99)64(106-26)118-61-60(117-66-52(98)46(92)44(90)35(21-79)110-66)55(108-28(3)81)27(2)107-70(61)119-71(102)77-17-16-72(4,5)18-30(77)29-10-11-37-73(6)14-13-39(74(7,25-80)36(73)12-15-75(37,8)76(29,9)19-38(77)85)111-69-59(48(94)47(93)56(113-69)62(100)101)115-65-51(97)45(91)43(89)34(20-78)109-65/h10,25-27,30-61,63-70,78-79,82-99H,11-24H2,1-9H3,(H,100,101)/t26-,27+,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+,60-,61+,63+,64-,65-,66-,67+,68+,69+,70-,73-,74-,75+,76+,77+/m0/s1 |
| InChIKey | OATVNTQBPPEYFV-JXMDKODJSA-N |
| Literature Reference Author | M.A.LACAILLE-DUBOIS,B.HANQUET,Z.H.CUI,Z.C.LOU,H.WAGNER |
| Literature Reference Citation | J.NAT.PROD.,62,133(1999) |
| Literature Reference DOI | 10.1021/np980172y |
| Molecular Weight | 1717.775 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS20443 |