![NUDICAUCIN-C;BETA-D-GLUCOPYRANOSYL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL(3->1)-BETA-D-GLUCOPYRANOSYL]-OLEANOATE](/api/spectrum/oQjnUJUEmJ/structure.png?h=300&w=458 "NUDICAUCIN-C;BETA-D-GLUCOPYRANOSYL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL(3->1)-BETA-D-GLUCOPYRANOSYL]-OLEANOATE")
| SpectraBase Compound ID | B6fuj8gnlG7 |
|---|---|
| InChI | InChI=1S/C53H86O21/c1-23-32(57)35(60)38(63)43(68-23)73-42-41(72-44-39(64)36(61)33(58)27(20-54)69-44)26(56)22-67-46(42)71-31-12-13-50(6)29(49(31,4)5)11-14-52(8)30(50)10-9-24-25-19-48(2,3)15-17-53(25,18-16-51(24,52)7)47(66)74-45-40(65)37(62)34(59)28(21-55)70-45/h9,23,25-46,54-65H,10-22H2,1-8H3/t23-,25?,26+,27-,28-,29?,30?,31+,32-,33-,34-,35+,36+,37+,38+,39-,40-,41+,42-,43-,44+,45+,46+,50+,51-,52-,53+/m1/s1 |
| InChIKey | ULSOTXJNUTYKRK-YFQUYGKESA-N |
| Mol Weight | 1059.2 g/mol |
| Molecular Formula | C53H86O21 |
| Exact Mass | 1058.56616 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | oQjnUJUEmJ |
|---|---|
| Name | NUDICAUCIN-C;BETA-D-GLUCOPYRANOSYL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL(3->1)-BETA-D-GLUCOPYRANOSYL]-OLEANOATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H86O21 |
| InChI | InChI=1S/C53H86O21/c1-23-32(57)35(60)38(63)43(68-23)73-42-41(72-44-39(64)36(61)33(58)27(20-54)69-44)26(56)22-67-46(42)71-31-12-13-50(6)29(49(31,4)5)11-14-52(8)30(50)10-9-24-25-19-48(2,3)15-17-53(25,18-16-51(24,52)7)47(66)74-45-40(65)37(62)34(59)28(21-55)70-45/h9,23,25-46,54-65H,10-22H2,1-8H3/t23-,25?,26+,27-,28-,29?,30?,31+,32-,33-,34-,35+,36+,37+,38+,39-,40-,41+,42-,43-,44+,45+,46+,50+,51-,52-,53+/m1/s1 |
| InChIKey | ULSOTXJNUTYKRK-YFQUYGKESA-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 | 1059.253 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS1067 |