| SpectraBase Compound ID | Qcv0kXuH2H |
|---|---|
| InChI | InChI=1S/C52H82O23/c1-22(54)30-14-17-52(62)50(30,8)46(70-27(6)56)44(69-26(5)55)45-49(7)15-13-29(18-28(49)12-16-51(45,52)61)71-34-19-31(63-9)40(23(2)66-34)73-35-20-32(64-10)41(24(3)67-35)74-48-39(60)43(65-11)42(25(4)68-48)75-47-38(59)37(58)36(57)33(21-53)72-47/h12,23-25,29-48,53,57-62H,13-21H2,1-11H3/t23-,24+,25-,29+,30-,31+,32-,33+,34+,35-,36+,37-,38+,39-,40-,41+,42-,43+,44+,45-,46-,47-,48+,49+,50+,51+,52-/m1/s1 |
| InChIKey | KVOZRVMOWBNUAK-UAZMOQBLSA-N |
| Mol Weight | 1075.2 g/mol |
| Molecular Formula | C52H82O23 |
| Exact Mass | 1074.524689 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 71ToNAaGgVN |
|---|---|
| Name | HOYACARNOSIDE-J |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H82O23 |
| InChI | InChI=1S/C52H82O23/c1-22(54)30-14-17-52(62)50(30,8)46(70-27(6)56)44(69-26(5)55)45-49(7)15-13-29(18-28(49)12-16-51(45,52)61)71-34-19-31(63-9)40(23(2)66-34)73-35-20-32(64-10)41(24(3)67-35)74-48-39(60)43(65-11)42(25(4)68-48)75-47-38(59)37(58)36(57)33(21-53)72-47/h12,23-25,29-48,53,57-62H,13-21H2,1-11H3/t23-,24+,25-,29+,30-,31+,32-,33+,34+,35-,36+,37-,38+,39-,40-,41+,42-,43+,44+,45-,46-,47-,48+,49+,50+,51+,52-/m1/s1 |
| InChIKey | KVOZRVMOWBNUAK-UAZMOQBLSA-N |
| Literature Reference Author | F.ABE,H.FUJISHIMA,Y.IWASE,T.YAMAUCHI,K.KINJO,S.YAGA |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,1128(1999) |
| Literature Reference DOI | 10.1248/cpb.47.1128 |
| Molecular Weight | 1075.209 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU8179 |