| SpectraBase Compound ID | 9lk9WIIOKpf |
|---|---|
| InChI | InChI=1S/C61H100O25/c1-27(63)35-15-18-61(70)59(35,8)43(65)25-42-58(7)16-14-34(19-33(58)13-17-60(42,61)69)80-44-20-36(64)52(28(2)75-44)82-45-21-37(71-9)53(29(3)76-45)83-46-22-38(72-10)54(30(4)77-46)84-47-23-39(73-11)55(31(5)78-47)85-48-24-40(74-12)56(32(6)79-48)86-57-51(68)50(67)49(66)41(26-62)81-57/h13,28-32,34-57,62,64-70H,14-26H2,1-12H3/t28-,29-,30+,31-,32+,34-,35+,36-,37-,38+,39+,40+,41-,42+,43+,44+,45+,46-,47+,48-,49-,50+,51-,52-,53-,54+,55-,56+,57+,58-,59-,60-,61+/m0/s1 |
| InChIKey | CBRTWEZOADOUBA-PSTKDJLCSA-N |
| Mol Weight | 1233.4 g/mol |
| Molecular Formula | C61H100O25 |
| Exact Mass | 1232.655369 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FYQID2PLAwF |
|---|---|
| Name | ISOLINEOLON-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)- |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C61H100O25 |
| InChI | InChI=1S/C61H100O25/c1-27(63)35-15-18-61(70)59(35,8)43(65)25-42-58(7)16-14-34(19-33(58)13-17-60(42,61)69)80-44-20-36(64)52(28(2)75-44)82-45-21-37(71-9)53(29(3)76-45)83-46-22-38(72-10)54(30(4)77-46)84-47-23-39(73-11)55(31(5)78-47)85-48-24-40(74-12)56(32(6)79-48)86-57-51(68)50(67)49(66)41(26-62)81-57/h13,28-32,34-57,62,64-70H,14-26H2,1-12H3/t28-,29-,30+,31-,32+,34-,35+,36-,37-,38+,39+,40+,41-,42+,43+,44+,45+,46-,47+,48-,49-,50+,51-,52-,53-,54+,55-,56+,57+,58-,59-,60-,61+/m0/s1 |
| InChIKey | CBRTWEZOADOUBA-PSTKDJLCSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,99(2000) |
| Literature Reference DOI | 10.1248/cpb.48.99 |
| Molecular Weight | 1233.450 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4833 |