| SpectraBase Compound ID | 9Uw7IB9O8Sf |
|---|---|
| InChI | InChI=1S/C29H46O6/c1-16-5-8-28(34-15-16)17(2)25-23(35-28)13-20-24-21(14-29(27(20,25)4)32-9-10-33-29)26(3)7-6-19(30)11-18(26)12-22(24)31/h16-25,30-31H,5-15H2,1-4H3/t16-,17+,18-,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+/m1/s1 |
| InChIKey | IFGWPPWTXPXBSU-PNAVYFCYSA-N |
| Mol Weight | 490.7 g/mol |
| Molecular Formula | C29H46O6 |
| Exact Mass | 490.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GFRyCxPyWVl |
|---|---|
| Name | (25R)-12-ETHYLENEDIOXY-5-ALPHA-SPIROSTAN-3-BETA,7-BETA-DIOL |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O6 |
| InChI | InChI=1S/C29H46O6/c1-16-5-8-28(34-15-16)17(2)25-23(35-28)13-20-24-21(14-29(27(20,25)4)32-9-10-33-29)26(3)7-6-19(30)11-18(26)12-22(24)31/h16-25,30-31H,5-15H2,1-4H3/t16-,17+,18-,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+/m1/s1 |
| InChIKey | IFGWPPWTXPXBSU-PNAVYFCYSA-N |
| Literature Reference Author | A.V.PATEL,G.BLUNDEN,T.A.CRABB |
| Literature Reference Citation | PHYTOCHEM.,35,125(1994) |
| Literature Reference DOI | 10.1016/s0031-9422(00)90520-x |
| Molecular Weight | 490.681 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU24097 |