| SpectraBase Spectrum ID |
8DbYuBmOoet |
| Name |
3.ALPHA.,5-CYCLO-5.ALPHA.-PREGNAN-6.BETA.,21-DIOL-20-ONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
332.235144887 u |
| Formula |
C21H32O3 |
| InChI |
InChI=1S/C21H32O3/c1-19-7-6-15-13(14(19)3-4-16(19)17(23)11-22)9-18(24)21-10-12(21)5-8-20(15,21)2/h12-16,18,22,24H,3-11H2,1-2H3/t12-,13-,14-,15-,16+,18+,19-,20+,21+/m0/s1 |
| InChIKey |
SDVLRZNAKXDOHD-OUCCJGILSA-N |
| Molecular Weight |
332.484 g/mol |
| Nominal Mass |
332 u |
| Number of Peaks |
87 |
| SMILES |
O[C@@]1(C[C@]2([C@@]3(CC[C@](C(CO)=O)([C@]3(CC[C@@]2([C@]2(CC[C@]3(C[C@@]123)[H])C)[H])C)[H])[H])[H])[H] |
| SPLASH |
splash10-0zfr-9636000000-e5c00b055f1686c6e9bc |
| Source File Reference |
LMCM-51531-475P |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
2-HYDROXY-1-(10-HYDROXY-3A,5A-DIMETHYLHEXADECAHYDROCYCLOPENTA[A]CYCLOPROPA[2,3]CYCLOPENTA[1,2-F]NAPHTHALEN-6-YL)ETHANONE |
| Wiley ID |
4_370 |
