![3-BETA-[(O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACT](/api/spectrum/FsiSKJdWTdY/structure.png?h=300&w=458 "3-BETA-[(O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACT")
| SpectraBase Compound ID | 3uY7QqqaNlM |
|---|---|
| InChI | InChI=1S/C50H78O27/c1-17(55)20-6-7-21-19-5-4-18-10-25(23(56)11-50(18,3)22(19)8-9-49(20,21)2)69-45-38(66)35(63)40(29(15-54)73-45)74-48-43(42(33(61)28(14-53)72-48)76-44-36(64)30(58)24(57)16-68-44)77-47-39(67)41(32(60)27(13-52)71-47)75-46-37(65)34(62)31(59)26(12-51)70-46/h4,6,19,21-48,51-54,56-67H,5,7-16H2,1-3H3/t19-,21-,22-,23+,24-,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-/m0/s1 |
| InChIKey | AZDNJBBUCLAIIW-ZXZONVAQSA-N |
| Mol Weight | 1111.1 g/mol |
| Molecular Formula | C50H78O27 |
| Exact Mass | 1110.473047 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FsiSKJdWTdY |
|---|---|
| Name | 3-BETA-[(O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-XYLOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACT |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H78O27 |
| InChI | InChI=1S/C50H78O27/c1-17(55)20-6-7-21-19-5-4-18-10-25(23(56)11-50(18,3)22(19)8-9-49(20,21)2)69-45-38(66)35(63)40(29(15-54)73-45)74-48-43(42(33(61)28(14-53)72-48)76-44-36(64)30(58)24(57)16-68-44)77-47-39(67)41(32(60)27(13-52)71-47)75-46-37(65)34(62)31(59)26(12-51)70-46/h4,6,19,21-48,51-54,56-67H,5,7-16H2,1-3H3/t19-,21-,22-,23+,24-,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-/m0/s1 |
| InChIKey | AZDNJBBUCLAIIW-ZXZONVAQSA-N |
| Literature Reference Author | Y.MIMAKI,K.WATANABE,H.SAKAGAMI,Y.SASHIDA |
| Literature Reference Citation | J.NAT.PROD.,65,1863(2002) |
| Literature Reference DOI | 10.1021/np020276f |
| Molecular Weight | 1111.153 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI16514 |