| SpectraBase Compound ID | eOLLXXJMB |
|---|---|
| InChI | InChI=1S/C32H44O11/c1-15-27(42-16(2)33)28(39-5)26(37)29(41-15)43-23-11-18-6-7-20-25(30(18,3)12-21(23)34)22(35)13-31(4)19(8-9-32(20,31)38)17-10-24(36)40-14-17/h8,10,15,18,20-21,23,25-29,34,37-38H,6-7,9,11-14H2,1-5H3/t15-,18+,20+,21+,23+,25+,26-,27+,28-,29+,30-,31+,32-/m0/s1 |
| InChIKey | SSNIVFZPYRBNCY-XRPBCYKJSA-N |
| Mol Weight | 604.7 g/mol |
| Molecular Formula | C32H44O11 |
| Exact Mass | 604.288362 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AnbsfsukZjf |
|---|---|
| Name | AFFINOSIDE-S-VII,(2-ALPHA-OH,3-BETA-O-(4'-OAC-DIGITALOSID),5-BETA-H) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H44O11 |
| InChI | InChI=1S/C32H44O11/c1-15-27(42-16(2)33)28(39-5)26(37)29(41-15)43-23-11-18-6-7-20-25(30(18,3)12-21(23)34)22(35)13-31(4)19(8-9-32(20,31)38)17-10-24(36)40-14-17/h8,10,15,18,20-21,23,25-29,34,37-38H,6-7,9,11-14H2,1-5H3/t15-,18+,20+,21+,23+,25+,26-,27+,28-,29+,30-,31+,32-/m0/s1 |
| InChIKey | SSNIVFZPYRBNCY-XRPBCYKJSA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,31,1199(1983) |
| Literature Reference DOI | 10.1248/cpb.31.1199 |
| Molecular Weight | 604.695 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UNIW8487 |