![NUDICAUCIN-A;BETA-D-GLUCOPYRANOSYL-3-O-[BETA-D-GALACTOPYRANOSYL-(1->3)-ALPHA-L-ARABINOPYRANOSYL]-30-NOROLEAN-12,20(29)-DIEN-28-OATE](/api/spectrum/96ZACNR4Bcz/structure.png?h=300&w=458 "NUDICAUCIN-A;BETA-D-GLUCOPYRANOSYL-3-O-[BETA-D-GALACTOPYRANOSYL-(1->3)-ALPHA-L-ARABINOPYRANOSYL]-30-NOROLEAN-12,20(29)-DIEN-28-OATE")
| SpectraBase Compound ID | 3weNAh5e0Qj |
|---|---|
| InChI | InChI=1S/C46H72O17/c1-21-9-14-46(41(57)63-40-35(55)33(53)31(51)26(19-48)60-40)16-15-44(5)22(23(46)17-21)7-8-28-43(4)12-11-29(42(2,3)27(43)10-13-45(28,44)6)61-38-36(56)37(24(49)20-58-38)62-39-34(54)32(52)30(50)25(18-47)59-39/h7,23-40,47-56H,1,8-20H2,2-6H3/t23?,24-,25+,26+,27?,28?,29-,30-,31+,32-,33-,34+,35+,36+,37-,38-,39-,40-,43-,44+,45+,46-/m0/s1 |
| InChIKey | WXWFCULTYPZHJI-ATOSZZPZSA-N |
| Mol Weight | 897.1 g/mol |
| Molecular Formula | C46H72O17 |
| Exact Mass | 896.476951 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 96ZACNR4Bcz |
|---|---|
| Name | NUDICAUCIN-A;BETA-D-GLUCOPYRANOSYL-3-O-[BETA-D-GALACTOPYRANOSYL-(1->3)-ALPHA-L-ARABINOPYRANOSYL]-30-NOROLEAN-12,20(29)-DIEN-28-OATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H72O17 |
| InChI | InChI=1S/C46H72O17/c1-21-9-14-46(41(57)63-40-35(55)33(53)31(51)26(19-48)60-40)16-15-44(5)22(23(46)17-21)7-8-28-43(4)12-11-29(42(2,3)27(43)10-13-45(28,44)6)61-38-36(56)37(24(49)20-58-38)62-39-34(54)32(52)30(50)25(18-47)59-39/h7,23-40,47-56H,1,8-20H2,2-6H3/t23?,24-,25+,26+,27?,28?,29-,30-,31+,32-,33-,34+,35+,36+,37-,38-,39-,40-,43-,44+,45+,46-/m0/s1 |
| InChIKey | WXWFCULTYPZHJI-ATOSZZPZSA-N |
| Literature Reference Author | M.KONISHI,Y.HANO,M.TAKAYAMA,T.NOMURA,A.S.HAMZAH,R.B.AHMAD,H. JASMANI |
| Literature Reference Citation | PHYTOCHEM.,48,525(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00038-7 |
| Molecular Weight | 897.067 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1064 |