| SpectraBase Compound ID | CiFrLcbJJkN |
|---|---|
| InChI | InChI=1S/C27H42O7/c1-13-12-33-27(11-18(13)28)14(2)23-21(34-27)8-17-15-7-22(31)26(32)10-20(30)19(29)9-25(26,4)16(15)5-6-24(17,23)3/h13-21,23,28-30,32H,5-12H2,1-4H3/t13-,14+,15-,16+,17+,18?,19-,20-,21+,23+,24+,25-,26-,27-/m1/s1 |
| InChIKey | JYSZQOPMKVJFGC-KBLFAXKWSA-N |
| Mol Weight | 478.6 g/mol |
| Molecular Formula | C27H42O7 |
| Exact Mass | 478.293054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DQZuZU4sqlb |
|---|---|
| Name | ANZUROGENIN-C;(25S)-2-ALPHA,3-BETA,5-BETA,24-TETRAHYDROXY-SPIROSTAN-6-ONE |
| Compound Number | 54 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O7 |
| InChI | InChI=1S/C27H42O7/c1-13-12-33-27(11-18(13)28)14(2)23-21(34-27)8-17-15-7-22(31)26(32)10-20(30)19(29)9-25(26,4)16(15)5-6-24(17,23)3/h13-21,23,28-30,32H,5-12H2,1-4H3/t13-,14+,15-,16+,17+,18?,19-,20-,21+,23+,24+,25-,26-,27-/m1/s1 |
| InChIKey | JYSZQOPMKVJFGC-KBLFAXKWSA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,A.K.PATHAK |
| Literature Reference Citation | MAGN.RES.CHEM.,33,923(1995) |
| Literature Reference DOI | 10.1002/mrc.1260331202 |
| Molecular Weight | 478.626 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS22142 |