![PREGNANE-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-OLEANDROPYRANOSYL-(1->4)-CYMAROPYRANOSYL-(1->4)-CYMAROPYRANOSIDE]](/api/spectrum/1Ygcb9iObUp/structure.png?h=300&w=458 "PREGNANE-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-OLEANDROPYRANOSYL-(1->4)-CYMAROPYRANOSYL-(1->4)-CYMAROPYRANOSIDE]")
| SpectraBase Compound ID | 8ITm51EBqQ6 |
|---|---|
| InChI | InChI=1S/C49H80O18/c1-23(50)30-17-37(52)49(55)47(30,7)36(51)22-35-46(6)14-13-29(16-28(46)12-15-48(35,49)54)64-38-19-32(57-9)43(25(3)61-38)66-40-21-34(59-11)45(27(5)63-40)67-41-20-33(58-10)44(26(4)62-41)65-39-18-31(56-8)42(53)24(2)60-39/h12,24-27,29-45,51-55H,13-22H2,1-11H3/t24-,25+,26+,27-,29-,30-,31-,32-,33+,34+,35+,36+,37+,38-,39+,40+,41-,42-,43+,44+,45-,46-,47-,48-,49+/m0/s1 |
| InChIKey | OJURYBCRENKRHL-LGSQBWCOSA-N |
| Mol Weight | 957.2 g/mol |
| Molecular Formula | C49H80O18 |
| Exact Mass | 956.534466 g/mol |
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| SpectraBase Spectrum ID | 1Ygcb9iObUp |
|---|---|
| Name | PREGNANE-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-OLEANDROPYRANOSYL-(1->4)-CYMAROPYRANOSYL-(1->4)-CYMAROPYRANOSIDE] |
| Compound Number | 34 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H80O18 |
| InChI | InChI=1S/C49H80O18/c1-23(50)30-17-37(52)49(55)47(30,7)36(51)22-35-46(6)14-13-29(16-28(46)12-15-48(35,49)54)64-38-19-32(57-9)43(25(3)61-38)66-40-21-34(59-11)45(27(5)63-40)67-41-20-33(58-10)44(26(4)62-41)65-39-18-31(56-8)42(53)24(2)60-39/h12,24-27,29-45,51-55H,13-22H2,1-11H3/t24-,25+,26+,27-,29-,30-,31-,32-,33+,34+,35+,36+,37+,38-,39+,40+,41-,42-,43+,44+,45-,46-,47-,48-,49+/m0/s1 |
| InChIKey | OJURYBCRENKRHL-LGSQBWCOSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | PHYTOCHEM.,53,485(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00560-9 |
| Molecular Weight | 957.163 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU2052 |