| SpectraBase Compound ID | 7lANV4Fh2Fn |
|---|---|
| InChI | InChI=1S/C32H46O7S/c1-17(24-16-31(6)28(2,3)38-32(37-24,39-31)26(35)27(36)40-7)20-8-9-21-25-22(11-13-30(20,21)5)29(4)12-10-19(33)14-18(29)15-23(25)34/h10,12,14,17,20-26,34-35H,8-9,11,13,15-16H2,1-7H3/t17-,20?,21?,22?,23+,24+,25?,26?,29-,30+,31+,32-/m0/s1 |
| InChIKey | IEAFGRSTVJUPIC-ZFZIXYMESA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C32H46O7S |
| Exact Mass | 574.296425 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CP3kovTMM6r |
|---|---|
| Name | 30-HYDROXYPETUNIASTERONE-A |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H46O7S |
| InChI | InChI=1S/C32H46O7S/c1-17(24-16-31(6)28(2,3)38-32(37-24,39-31)26(35)27(36)40-7)20-8-9-21-25-22(11-13-30(20,21)5)29(4)12-10-19(33)14-18(29)15-23(25)34/h10,12,14,17,20-26,34-35H,8-9,11,13,15-16H2,1-7H3/t17-,20?,21?,22?,23+,24+,25?,26?,29-,30+,31+,32-/m0/s1 |
| InChIKey | IEAFGRSTVJUPIC-ZFZIXYMESA-N |
| Literature Reference Author | K.SHINGU,H.FUJII,K.MIZUKI,I.UEDA,S.YAHARA,T.NOHARA |
| Literature Reference Citation | PHYTOCHEM.,36,1307(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89657-0 |
| Molecular Weight | 574.773 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26318 |