| SpectraBase Compound ID | EByQl7S1hrD |
|---|---|
| InChI | InChI=1S/C25H36O7/c1-14(26)32-20-11-17-18(23(3)7-4-16(27)12-25(20,23)30)5-8-22(2)19(17)6-9-24(22,29)15-10-21(28)31-13-15/h10,16-20,27,29-30H,4-9,11-13H2,1-3H3/t16-,17-,18+,19+,20?,22+,23-,24+,25+/m1/s1 |
| InChIKey | AICIDYVCLPNBHD-CUKBLNFBSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C25H36O7 |
| Exact Mass | 448.246103 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Dc6m1NRZms |
|---|---|
| Name | 3-ALPHA,5-ALPHA,17-ALPHA-TRIHYDROXY-6-O-ACETYL-17-BETA-(2',5'-DIHYDRO-5'-OXO-3'-FURYL)-ANDROSTANE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H36O7 |
| InChI | InChI=1S/C25H36O7/c1-14(26)32-20-11-17-18(23(3)7-4-16(27)12-25(20,23)30)5-8-22(2)19(17)6-9-24(22,29)15-10-21(28)31-13-15/h10,16-20,27,29-30H,4-9,11-13H2,1-3H3/t16-,17-,18+,19+,20?,22+,23-,24+,25+/m1/s1 |
| InChIKey | AICIDYVCLPNBHD-CUKBLNFBSA-N |
| Literature Reference Author | V.WRAY,S.LANG |
| Literature Reference Citation | TETRAHEDRON,31,2815(1975) |
| Literature Reference DOI | 10.1016/0040-4020(75)80296-1 |
| Molecular Weight | 448.557 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UNIW8449 |