![#1;25S-26-O-BETA-D-GLUCOPYRANOSYL-5-ALPHA-FUROSTAN-3-BETA,22-ALPHA,26-TRIOL-3-O-BETA-D-GALACTOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOP](/api/spectrum/4NfohMewyGo/structure.png?h=300&w=458 "#1;25S-26-O-BETA-D-GLUCOPYRANOSYL-5-ALPHA-FUROSTAN-3-BETA,22-ALPHA,26-TRIOL-3-O-BETA-D-GALACTOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOP")
| SpectraBase Compound ID | CnGnbQPRX3W |
|---|---|
| InChI | InChI=1S/C57H96O29/c1-21(20-76-50-43(71)39(67)35(63)29(15-58)78-50)7-12-57(75)22(2)34-28(86-57)14-27-25-6-5-23-13-24(8-10-55(23,3)26(25)9-11-56(27,34)4)77-51-46(74)42(70)47(33(19-62)82-51)83-54-49(85-53-45(73)41(69)37(65)31(17-60)80-53)48(38(66)32(18-61)81-54)84-52-44(72)40(68)36(64)30(16-59)79-52/h21-54,58-75H,5-20H2,1-4H3/t21-,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-,51+,52-,53+,54+,55-,56-,57+/m0/s1 |
| InChIKey | XDAAGZSUPZBJED-OQOJIFKBSA-N |
| Mol Weight | 1245.4 g/mol |
| Molecular Formula | C57H96O29 |
| Exact Mass | 1244.603727 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4NfohMewyGo |
|---|---|
| Name | #1;25S-26-O-BETA-D-GLUCOPYRANOSYL-5-ALPHA-FUROSTAN-3-BETA,22-ALPHA,26-TRIOL-3-O-BETA-D-GALACTOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-O-BETA-D-GLUCOP |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H96O29 |
| InChI | InChI=1S/C57H96O29/c1-21(20-76-50-43(71)39(67)35(63)29(15-58)78-50)7-12-57(75)22(2)34-28(86-57)14-27-25-6-5-23-13-24(8-10-55(23,3)26(25)9-11-56(27,34)4)77-51-46(74)42(70)47(33(19-62)82-51)83-54-49(85-53-45(73)41(69)37(65)31(17-60)80-53)48(38(66)32(18-61)81-54)84-52-44(72)40(68)36(64)30(16-59)79-52/h21-54,58-75H,5-20H2,1-4H3/t21-,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-,51+,52-,53+,54+,55-,56-,57+/m0/s1 |
| InChIKey | XDAAGZSUPZBJED-OQOJIFKBSA-N |
| Literature Reference Author | A.TEMRAZ,O.D.E.GINDI,H.A.KADRY,N.D.TOMMASI,A.BRACA |
| Literature Reference Citation | PHYTOCHEM.,67,1011(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2006.03.007 |
| Molecular Weight | 1245.372 g/mol |
| Sample ID | 66248 |
| Solvent | CD3OD |