![(23S,24S)-SPIROSTA-5,25(27)-DIENE-1-BETA,3-BETA,23,24-TETROL-1-O-[O-(2,3-O-DIACETYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-O-[BETA-D-XYLOPARANOSYL-(1->3)]](/api/spectrum/3bmkBgh3RQ4/structure.png?h=300&w=458 "(23S,24S)-SPIROSTA-5,25(27)-DIENE-1-BETA,3-BETA,23,24-TETROL-1-O-[O-(2,3-O-DIACETYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-O-[BETA-D-XYLOPARANOSYL-(1->3)]")
| SpectraBase Compound ID | A08zsYKmH3z |
|---|---|
| InChI | InChI=1S/C47H70O20/c1-18-15-60-47(41(57)33(18)53)19(2)32-30(67-47)14-27-25-9-8-23-12-24(50)13-31(46(23,7)26(25)10-11-45(27,32)6)64-43-39(37(29(52)17-59-43)65-42-36(56)35(55)28(51)16-58-42)66-44-40(63-22(5)49)38(62-21(4)48)34(54)20(3)61-44/h8,19-20,24-44,50-57H,1,9-17H2,2-7H3/t19-,20+,24+,25+,26-,27-,28+,29+,30-,31+,32-,33-,34+,35-,36+,37+,38-,39-,40-,41-,42-,43+,44+,45-,46-,47-/m0/s1 |
| InChIKey | QZJCQJZANABERY-VBESXOMLSA-N |
| Mol Weight | 955.1 g/mol |
| Molecular Formula | C47H70O20 |
| Exact Mass | 954.446045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3bmkBgh3RQ4 |
|---|---|
| Name | (23S,24S)-SPIROSTA-5,25(27)-DIENE-1-BETA,3-BETA,23,24-TETROL-1-O-[O-(2,3-O-DIACETYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-O-[BETA-D-XYLOPARANOSYL-(1->3)] |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H70O20 |
| InChI | InChI=1S/C47H70O20/c1-18-15-60-47(41(57)33(18)53)19(2)32-30(67-47)14-27-25-9-8-23-12-24(50)13-31(46(23,7)26(25)10-11-45(27,32)6)64-43-39(37(29(52)17-59-43)65-42-36(56)35(55)28(51)16-58-42)66-44-40(63-22(5)49)38(62-21(4)48)34(54)20(3)61-44/h8,19-20,24-44,50-57H,1,9-17H2,2-7H3/t19-,20+,24+,25+,26-,27-,28+,29+,30-,31+,32-,33-,34+,35-,36+,37+,38-,39-,40-,41-,42-,43+,44+,45-,46-,47-/m0/s1 |
| InChIKey | QZJCQJZANABERY-VBESXOMLSA-N |
| Literature Reference Author | Y.MIMAKI,T.INOUE,M.KURODA,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,43,1325(1996) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00397-4 |
| Molecular Weight | 955.061 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS2423 |