| SpectraBase Compound ID | II3zQd7Nx9M |
|---|---|
| InChI | InChI=1S/C60H96O22/c1-15-28(2)56(65)78-44-26-43-57(9)18-17-36(20-35(57)16-19-59(43,66)60(67)27-38(63)50(29(3)61)58(44,60)10)77-45-21-37(62)52(31(5)73-45)79-47-23-40(69-12)54(32(6)74-47)81-49-25-42(71-14)55(34(8)76-49)82-48-24-41(70-13)53(33(7)75-48)80-46-22-39(68-11)51(64)30(4)72-46/h15-16,30-34,36-55,62-64,66-67H,17-27H2,1-14H3/b28-15+/t30-,31+,32+,33+,34-,36+,37+,38-,39-,40+,41-,42-,43-,44-,45-,46+,47-,48-,49+,50+,51-,52+,53+,54+,55-,57+,58-,59+,60-/m1/s1 |
| InChIKey | YMNNATMABXASDK-RDNFYXCJSA-N |
| Mol Weight | 1169.4 g/mol |
| Molecular Formula | C60H96O22 |
| Exact Mass | 1168.639325 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B8GcjAydTs8 |
|---|---|
| Name | 12-O-TYGLOYL-16-ALPHA-HYDROXYISOLINEOLON-3-O-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)- |
| Compound Number | 30 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H96O22 |
| InChI | InChI=1S/C60H96O22/c1-15-28(2)56(65)78-44-26-43-57(9)18-17-36(20-35(57)16-19-59(43,66)60(67)27-38(63)50(29(3)61)58(44,60)10)77-45-21-37(62)52(31(5)73-45)79-47-23-40(69-12)54(32(6)74-47)81-49-25-42(71-14)55(34(8)76-49)82-48-24-41(70-13)53(33(7)75-48)80-46-22-39(68-11)51(64)30(4)72-46/h15-16,30-34,36-55,62-64,66-67H,17-27H2,1-14H3/b28-15+/t30-,31+,32+,33+,34-,36+,37+,38-,39-,40+,41-,42-,43-,44-,45-,46+,47-,48-,49+,50+,51-,52+,53+,54+,55-,57+,58-,59+,60-/m1/s1 |
| InChIKey | YMNNATMABXASDK-RDNFYXCJSA-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 | 1169.409 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4840 |