| SpectraBase Compound ID | KhShjO03KCr |
|---|---|
| InChI | InChI=1S/C46H78O19/c1-19(18-59-41-38(56)36(54)33(51)29(16-47)62-41)9-12-46(58-6)20(2)31-28(65-46)14-25-23-8-7-22-13-27(26(49)15-45(22,5)24(23)10-11-44(25,31)4)61-43-40(37(55)34(52)30(17-48)63-43)64-42-39(57)35(53)32(50)21(3)60-42/h19-43,47-57H,7-18H2,1-6H3/t19-,20+,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?/m1/s1 |
| InChIKey | IWCHFVSWODZHFO-OUTBOTPMSA-N |
| Mol Weight | 935.1 g/mol |
| Molecular Formula | C46H78O19 |
| Exact Mass | 934.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J14EHRdXY5b |
|---|---|
| Name | #37;26-O-BETA-D-GLUCOPYRANOSYL-22-XI-METHOXY-2-ALPHA,3-BETA,26-TRIHYDROXY-(25R)-5-ALPHA-FUROSTANE-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H78O19 |
| InChI | InChI=1S/C46H78O19/c1-19(18-59-41-38(56)36(54)33(51)29(16-47)62-41)9-12-46(58-6)20(2)31-28(65-46)14-25-23-8-7-22-13-27(26(49)15-45(22,5)24(23)10-11-44(25,31)4)61-43-40(37(55)34(52)30(17-48)63-43)64-42-39(57)35(53)32(50)21(3)60-42/h19-43,47-57H,7-18H2,1-6H3/t19-,20+,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?/m1/s1 |
| InChIKey | IWCHFVSWODZHFO-OUTBOTPMSA-N |
| Literature Reference Author | P.K.AGRAWAL |
| Literature Reference Citation | STEROIDS,70,715(2005) |
| Literature Reference DOI | 10.1016/j.steroids.2005.04.001 |
| Molecular Weight | 935.114 g/mol |
| Sample ID | 968782 |
| Solvent | C5D5N |