| SpectraBase Compound ID | BG8dqU7jINN |
|---|---|
| InChI | InChI=1S/C24H32O6/c1-20(2)29-17-9-13-12-5-7-23-8-6-14(26)19(23)22(23,4)18(12)15(27)10-21(13,3)24(17,30-20)16(28)11-25/h6,8,12-13,15,17-19,25,27H,5,7,9-11H2,1-4H3/t12-,13-,15-,17+,18+,19+,21-,22-,23+,24+/m0/s1 |
| InChIKey | ZPYMBCCOAPDVHF-YUABLTTMSA-N |
| Mol Weight | 416.5 g/mol |
| Molecular Formula | C24H32O6 |
| Exact Mass | 416.219889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DbphNSKH54k |
|---|---|
| Name | 11-BETA,21-DIHYDROXY-16-ALPHA,17-ALPHA-(1-METHYLETHYLIDENEDIOXY)-1,5-CYCLOPREGN-3-ENE-2,20-DIONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H32O6 |
| InChI | InChI=1S/C24H32O6/c1-20(2)29-17-9-13-12-5-7-23-8-6-14(26)19(23)22(23,4)18(12)15(27)10-21(13,3)24(17,30-20)16(28)11-25/h6,8,12-13,15,17-19,25,27H,5,7,9-11H2,1-4H3/t12-,13-,15-,17+,18+,19+,21-,22-,23+,24+/m0/s1 |
| InChIKey | ZPYMBCCOAPDVHF-YUABLTTMSA-N |
| Literature Reference Author | J.IQBAL,A.HUSAIN,A.GUPTA |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,836(2006) |
| Literature Reference DOI | 10.1248/cpb.54.836 |
| Molecular Weight | 416.514 g/mol |
| Sample ID | 54865 |
| Solvent | DMSO-D6 |