| SpectraBase Compound ID | 7zVdii6tXID |
|---|---|
| InChI | InChI=1S/C58H86O20/c1-29-45(72-33(5)61)47(74-35(7)63)49(76-37(9)65)51(69-29)68-28-55(13)41-19-20-57(15)42(18-17-39-40-26-53(11,27-67-31(3)59)21-22-54(40,12)23-24-56(39,57)14)58(41,16)44(71-32(4)60)25-43(55)78-52-50(77-38(10)66)48(75-36(8)64)46(30(2)70-52)73-34(6)62/h17,29-30,40-52H,18-28H2,1-16H3/t29-,30-,40-,41?,42?,43-,44-,45-,46-,47+,48+,49+,50+,51+,52-,53+,54+,55-,56+,57+,58+/m0/s1 |
| InChIKey | JJIHITRRVXQXFT-IYTFRMRJSA-N |
| Mol Weight | 1103.3 g/mol |
| Molecular Formula | C58H86O20 |
| Exact Mass | 1102.571245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EFBAB3i4ZjC |
|---|---|
| Name | 1-ALPHA,3-BETA,23,29-TETRAHYDROXYOLEAN-12-ENE-3-O-ALPHA-L-RHAMNOPYRANOSYL-23-O-ALPHA-L-4-ACETYLRHAMNOPYRANOSIDE-PERACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H86O20 |
| InChI | InChI=1S/C58H86O20/c1-29-45(72-33(5)61)47(74-35(7)63)49(76-37(9)65)51(69-29)68-28-55(13)41-19-20-57(15)42(18-17-39-40-26-53(11,27-67-31(3)59)21-22-54(40,12)23-24-56(39,57)14)58(41,16)44(71-32(4)60)25-43(55)78-52-50(77-38(10)66)48(75-36(8)64)46(30(2)70-52)73-34(6)62/h17,29-30,40-52H,18-28H2,1-16H3/t29-,30-,40-,41?,42?,43-,44-,45-,46-,47+,48+,49+,50+,51+,52-,53+,54+,55-,56+,57+,58+/m0/s1 |
| InChIKey | JJIHITRRVXQXFT-IYTFRMRJSA-N |
| Literature Reference Author | C.B.ROGERS |
| Literature Reference Citation | J.NAT.PROD.,52,528(1989) |
| Literature Reference DOI | 10.1021/np50063a011 |
| Molecular Weight | 1103.309 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1256 |