| SpectraBase Compound ID | DJ8QeHmA9co |
|---|---|
| InChI | InChI=1S/C56H90O20/c1-26(2)21-40(59)73-52-50(71-32(8)58)44-36(56(62)20-18-35(27(3)57)55(52,56)10)16-15-33-22-34(17-19-54(33,44)9)72-41-23-37(63-11)47(29(5)67-41)74-42-24-38(64-12)48(30(6)68-42)75-43-25-39(65-13)49(31(7)69-43)76-53-46(61)51(66-14)45(60)28(4)70-53/h15,26,28-31,34-39,41-53,60-62H,16-25H2,1-14H3/t28-,29+,30-,31+,34-,35+,36+,37-,38+,39+,41-,42+,43-,44+,45-,46-,47+,48-,49+,50-,51-,52+,53+,54-,55-,56-/m0/s1 |
| InChIKey | DNBGHHQKCVFJFT-AAEBTNIESA-N |
| Mol Weight | 1083.3 g/mol |
| Molecular Formula | C56H90O20 |
| Exact Mass | 1082.602545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DNfHsvI9ASA |
|---|---|
| Name | DREGEOSIDE-AP-1 |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H90O20 |
| InChI | InChI=1S/C56H90O20/c1-26(2)21-40(59)73-52-50(71-32(8)58)44-36(56(62)20-18-35(27(3)57)55(52,56)10)16-15-33-22-34(17-19-54(33,44)9)72-41-23-37(63-11)47(29(5)67-41)74-42-24-38(64-12)48(30(6)68-42)75-43-25-39(65-13)49(31(7)69-43)76-53-46(61)51(66-14)45(60)28(4)70-53/h15,26,28-31,34-39,41-53,60-62H,16-25H2,1-14H3/t28-,29+,30-,31+,34-,35+,36+,37-,38+,39+,41-,42+,43-,44+,45-,46-,47+,48-,49+,50-,51-,52+,53+,54-,55-,56-/m0/s1 |
| InChIKey | DNBGHHQKCVFJFT-AAEBTNIESA-N |
| Literature Reference Author | F.ABE,H.FUJISHIMA,Y.IWASE,T.YAMAUCHI,K.KINJO,S.YAGA |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,1128(1999) |
| Literature Reference DOI | 10.1248/cpb.47.1128 |
| Molecular Weight | 1083.319 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU8172 |