| SpectraBase Compound ID | JwtBkiW2Bb |
|---|---|
| InChI | InChI=1S/C51H84O22/c1-21(19-65-45-41(62)39(60)36(57)31(17-52)69-45)9-14-51(64-6)22(2)33-30(73-51)16-28-26-8-7-24-15-25(10-12-49(24,4)27(26)11-13-50(28,33)5)68-48-44(72-47-42(63)38(59)34(55)23(3)67-47)43(37(58)32(18-53)70-48)71-46-40(61)35(56)29(54)20-66-46/h7,21-23,25-48,52-63H,8-20H2,1-6H3/t21-,22+,23-,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-/m1/s1 |
| InChIKey | ANRCURCEMLFKEB-KXXRNMIRSA-N |
| Mol Weight | 1049.2 g/mol |
| Molecular Formula | C51H84O22 |
| Exact Mass | 1048.545424 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JHS2u8Tc8l9 |
|---|---|
| Name | INDIOSIDE-B;(25R)-26-O-BETA-D-GLUCOPYRANOSYL-22-ALPHA-METHOXYFUROST-5-EN-3-BETA,26-DIOL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPARANOSYL-( |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H84O22 |
| InChI | InChI=1S/C51H84O22/c1-21(19-65-45-41(62)39(60)36(57)31(17-52)69-45)9-14-51(64-6)22(2)33-30(73-51)16-28-26-8-7-24-15-25(10-12-49(24,4)27(26)11-13-50(28,33)5)68-48-44(72-47-42(63)38(59)34(55)23(3)67-47)43(37(58)32(18-53)70-48)71-46-40(61)35(56)29(54)20-66-46/h7,21-23,25-48,52-63H,8-20H2,1-6H3/t21-,22+,23-,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-/m1/s1 |
| InChIKey | ANRCURCEMLFKEB-KXXRNMIRSA-N |
| Literature Reference Author | S.YAHARA,T.NALAMURA,Y.SOMEYA,T.MATSUMOTO,T.YAMASHITA,T.NOHAR A |
| Literature Reference Citation | PHYTOCHEM.,43,1319(1996) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00395-0 |
| Molecular Weight | 1049.215 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS2412 |