| SpectraBase Compound ID | 3Y8oc5Pq3R7 |
|---|---|
| InChI | InChI=1S/C43H66O15/c1-38(2)12-14-43(37(53)58-36-32(51)31(50)30(49)26(19-44)56-36)15-13-41(5)21(22(43)17-38)8-9-28-39(3)18-24(47)33(40(4,20-45)27(39)10-11-42(28,41)6)57-35-29(48)23(46)16-25(55-35)34(52)54-7/h8,16,22-24,26-33,35-36,44-51H,9-15,17-20H2,1-7H3/t22?,23-,24-,26+,27?,28?,29+,30+,31-,32+,33-,35-,36-,39-,40-,41+,42+,43-/m0/s1 |
| InChIKey | NCPCXLXZPPAVQU-JNRIXJJKSA-N |
| Mol Weight | 823.0 g/mol |
| Molecular Formula | C43H66O15 |
| Exact Mass | 822.440171 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A5oe8g89zD6 |
|---|---|
| Name | 28-O-BETA-D-GLUCOPYRANOSYL-BAYOGENIN-3-O-6'-O-METHYL-4'-ANHYDRO-4',5'-DIDEHYDRO-BETA-D-GLUCURONOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H66O15 |
| InChI | InChI=1S/C43H66O15/c1-38(2)12-14-43(37(53)58-36-32(51)31(50)30(49)26(19-44)56-36)15-13-41(5)21(22(43)17-38)8-9-28-39(3)18-24(47)33(40(4,20-45)27(39)10-11-42(28,41)6)57-35-29(48)23(46)16-25(55-35)34(52)54-7/h8,16,22-24,26-33,35-36,44-51H,9-15,17-20H2,1-7H3/t22?,23-,24-,26+,27?,28?,29+,30+,31-,32+,33-,35-,36-,39-,40-,41+,42+,43-/m0/s1 |
| InChIKey | NCPCXLXZPPAVQU-JNRIXJJKSA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI,H.SHIBUYA,I.KITAGAWA |
| Literature Reference Citation | PHYTOCHEM.,42,809(1996) |
| Literature Reference DOI | 10.1016/0031-9422(96)00003-9 |
| Molecular Weight | 822.988 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU3692 |