| SpectraBase Compound ID | JkoJEww7Iqh |
|---|---|
| InChI | InChI=1S/C33H50O10/c1-16-8-13-33(39-15-16)17(2)25-24(43-33)14-23-21-9-12-32(38)29(42-20(5)36)27(40-18(3)34)26(37)28(41-19(4)35)31(32,7)22(21)10-11-30(23,25)6/h16-17,21-29,37-38H,8-15H2,1-7H3/t16-,17+,21-,22+,23+,24+,25+,26-,27+,28-,29+,30+,31+,32+,33-/m1/s1 |
| InChIKey | MCLCQIWIFLHCKL-CXODHJJRSA-N |
| Mol Weight | 606.8 g/mol |
| Molecular Formula | C33H50O10 |
| Exact Mass | 606.340398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JUcjXXBQ1eP |
|---|---|
| Name | 1-BETA,3-BETA,4-BETA-O-TRIACETYL-NEOPENTOLOGENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H50O10 |
| InChI | InChI=1S/C33H50O10/c1-16-8-13-33(39-15-16)17(2)25-24(43-33)14-23-21-9-12-32(38)29(42-20(5)36)27(40-18(3)34)26(37)28(41-19(4)35)31(32,7)22(21)10-11-30(23,25)6/h16-17,21-29,37-38H,8-15H2,1-7H3/t16-,17+,21-,22+,23+,24+,25+,26-,27+,28-,29+,30+,31+,32+,33-/m1/s1 |
| InChIKey | MCLCQIWIFLHCKL-CXODHJJRSA-N |
| Literature Reference Author | T.KONISHI,S.KIYOSAWA,J.SHOJI |
| Literature Reference Citation | CHEM.PHARM.BULL.,32,1451(1984) |
| Literature Reference DOI | 10.1248/cpb.32.1451 |
| Molecular Weight | 606.754 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UNIW17022 |