| SpectraBase Compound ID | zkxCoZyurw |
|---|---|
| InChI | InChI=1S/C39H62O14/c1-18-28(42)30(44)32(46)34(49-18)52-33-31(45)29(43)26(16-41)51-35(33)50-22-8-10-36(3)21(13-22)5-6-23-24(36)9-11-37(4)25(23)14-27-39(37,47)19(2)38(53-27)12-7-20(15-40)17-48-38/h5,18-20,22-35,40-47H,6-17H2,1-4H3/t18-,19+,20-,22-,23+,24-,25-,26+,27-,28-,29+,30+,31-,32+,33+,34-,35+,36-,37-,38-,39+/m0/s1 |
| InChIKey | BIZGSQNPUFAPKU-SCNPNMRWSA-N |
| Mol Weight | 754.9 g/mol |
| Molecular Formula | C39H62O14 |
| Exact Mass | 754.413957 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Als6Dnv5ryq |
|---|---|
| Name | (25S)-27-HYDROXY-PENOGENIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H62O14 |
| InChI | InChI=1S/C39H62O14/c1-18-28(42)30(44)32(46)34(49-18)52-33-31(45)29(43)26(16-41)51-35(33)50-22-8-10-36(3)21(13-22)5-6-23-24(36)9-11-37(4)25(23)14-27-39(37,47)19(2)38(53-27)12-7-20(15-40)17-48-38/h5,18-20,22-35,40-47H,6-17H2,1-4H3/t18-,19+,20-,22-,23+,24-,25-,26+,27-,28-,29+,30+,31-,32+,33+,34-,35+,36-,37-,38-,39+/m0/s1 |
| InChIKey | BIZGSQNPUFAPKU-SCNPNMRWSA-N |
| Literature Reference Author | M.ONO,C.TAKAMURA,F.SUGITA,C.MASUOKA,H.YOSHIMITSU,T.IKEDA,T.N OHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,551(2007) |
| Literature Reference DOI | 10.1248/cpb.55.551 |
| Molecular Weight | 754.913 g/mol |
| Sample ID | 55521 |
| Solvent | C5D5N |