| SpectraBase Compound ID | KNfdEZ0PypP |
|---|---|
| InChI | InChI=1S/C33H52O7/c1-19(35)39-25-12-13-30(6)23(28(25,3)4)11-14-32(8)24(30)10-9-21-22-17-33(38,18-34)26(37)27(40-20(2)36)29(22,5)15-16-31(21,32)7/h9,22-27,34,37-38H,10-18H2,1-8H3/t22-,23-,24+,25+,26+,27-,29+,30-,31+,32+,33-/m0/s1 |
| InChIKey | YSPMZADUIBWNLR-UXJDLBARSA-N |
| Mol Weight | 560.8 g/mol |
| Molecular Formula | C33H52O7 |
| Exact Mass | 560.371304 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9VryQIGZNfC |
|---|---|
| Name | 3-ALPHA,22-ALPHA-DIACETOXY-20-BETA,21-ALPHA,29-TRIHYDROXY-30-NOROLEAN-12-ENE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H52O7 |
| InChI | InChI=1S/C33H52O7/c1-19(35)39-25-12-13-30(6)23(28(25,3)4)11-14-32(8)24(30)10-9-21-22-17-33(38,18-34)26(37)27(40-20(2)36)29(22,5)15-16-31(21,32)7/h9,22-27,34,37-38H,10-18H2,1-8H3/t22-,23-,24+,25+,26+,27-,29+,30-,31+,32+,33-/m0/s1 |
| InChIKey | YSPMZADUIBWNLR-UXJDLBARSA-N |
| Literature Reference Author | C.M.LIU,H.X.WANG,S.L.WEI,K.GAO |
| Literature Reference Citation | J.NAT.PROD.,71,789(2008) |
| Literature Reference DOI | 10.1021/np070618n |
| Molecular Weight | 560.772 g/mol |
| Sample ID | 28232 |
| Solvent | DMSO-D6 |