| SpectraBase Compound ID | DpjwA45zLqp |
|---|---|
| InChI | InChI=1S/C53H78O20/c1-23-18-41(65-28(6)55)53(61-22-23)24(2)42-40(73-53)21-37-35-20-39(38-19-34(64-27(5)54)14-16-51(38,12)36(35)15-17-52(37,42)13)71-49-48(70-33(11)60)46(44(26(4)62-49)67-30(8)57)72-50-47(69-32(10)59)45(68-31(9)58)43(25(3)63-50)66-29(7)56/h23-26,34-50H,14-22H2,1-13H3/t23-,24+,25-,26+,34+,35-,36+,37+,38-,39+,40+,41+,42+,43-,44+,45+,46-,47+,48+,49-,50-,51-,52+,53+/m1/s1 |
| InChIKey | FGIHOLQBTQBJKH-LPTTXIMDSA-N |
| Mol Weight | 1035.2 g/mol |
| Molecular Formula | C53H78O20 |
| Exact Mass | 1034.508645 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GgnAnB4vwkR |
|---|---|
| Name | 6-ALPHA-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-QUINOVOPYRANOSYL-(25R)-5-ALPHA-SPIROSTAN-3-BETA,23-ALPHA-DIOL-PERACETATE |
| Compound Number | 6A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H78O20 |
| InChI | InChI=1S/C53H78O20/c1-23-18-41(65-28(6)55)53(61-22-23)24(2)42-40(73-53)21-37-35-20-39(38-19-34(64-27(5)54)14-16-51(38,12)36(35)15-17-52(37,42)13)71-49-48(70-33(11)60)46(44(26(4)62-49)67-30(8)57)72-50-47(69-32(10)59)45(68-31(9)58)43(25(3)63-50)66-29(7)56/h23-26,34-50H,14-22H2,1-13H3/t23-,24+,25-,26+,34+,35-,36+,37+,38-,39+,40+,41+,42+,43-,44+,45+,46-,47+,48+,49-,50-,51-,52+,53+/m1/s1 |
| InChIKey | FGIHOLQBTQBJKH-LPTTXIMDSA-N |
| Literature Reference Author | A.ZAMILPA,J.TORTORIELLO,V.NAVARRO,G.DELGADO,L.ALVAREZ |
| Literature Reference Citation | J.NAT.PROD.,65,1815(2002) |
| Literature Reference DOI | 10.1021/np020261h |
| Molecular Weight | 1035.190 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI16445 |