| SpectraBase Compound ID | EKmsjMxeufD |
|---|---|
| InChI | InChI=1S/C36H58O8/c1-31(2)14-16-36(30(41)42)17-15-34(6)20(21(36)18-31)8-9-24-33(5)12-11-25(32(3,4)23(33)10-13-35(24,34)7)44-29-28(40)27(39)26(38)22(19-37)43-29/h8,21-29,37-40H,9-19H2,1-7H3,(H,41,42)/t21?,22-,23?,24?,25+,26-,27+,28-,29+,33+,34-,35-,36+/m1/s1 |
| InChIKey | ZNFRITHWVZXJRK-SKEABOEQSA-N |
| Mol Weight | 618.9 g/mol |
| Molecular Formula | C36H58O8 |
| Exact Mass | 618.413169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CoYyc0kuiDB |
|---|---|
| Name | ANDROSEPTOSIDE-A;OLEANOLIC-ACID-3-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O8 |
| InChI | InChI=1S/C36H58O8/c1-31(2)14-16-36(30(41)42)17-15-34(6)20(21(36)18-31)8-9-24-33(5)12-11-25(32(3,4)23(33)10-13-35(24,34)7)44-29-28(40)27(39)26(38)22(19-37)43-29/h8,21-29,37-40H,9-19H2,1-7H3,(H,41,42)/t21?,22-,23?,24?,25+,26-,27+,28-,29+,33+,34-,35-,36+/m1/s1 |
| InChIKey | ZNFRITHWVZXJRK-SKEABOEQSA-N |
| Literature Reference Author | M.S.ABDEL-KADER,B.D.BAHLER,S.MALONE,M.C.M.WERKHOVEN,J.H.WISS E,K.M.NEDDERMANN,I.B |
| Literature Reference Citation | J.NAT.PROD.,63,1461(2000) |
| Literature Reference DOI | 10.1021/np0000926 |
| Molecular Weight | 618.852 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU2256 |