| SpectraBase Spectrum ID |
3H28O2NYYjV |
| Name |
7.ALPHA.-METHYL-ESTRA-1,3,5(10)-TRIENE-3-OL-17-ONE |
| CAS Registry Number |
10448-96-1 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
284.177630011 u |
| Formula |
C19H24O2 |
| InChI |
InChI=1S/C19H24O2/c1-11-9-12-10-13(20)3-4-14(12)15-7-8-19(2)16(18(11)15)5-6-17(19)21/h3-4,10-11,15-16,18,20H,5-9H2,1-2H3/t11-,15-,16+,18-,19+/m1/s1 |
| InChIKey |
JUAJXSMWFOFDFC-MNHDCVOLSA-N |
| Molecular Weight |
284.399 g/mol |
| Nominal Mass |
284 u |
| Number of Peaks |
101 |
| SMILES |
Oc1ccc2[C@]3(CC[C@@]4(C(CC[C@]4([C@@]3([C@@](Cc2c1)(C)[H])[H])[H])=O)C)[H] |
| SPLASH |
splash10-001i-1890000000-9792a9c8e3d817ecc374 |
| Source File Reference |
LMCM-42129-634N |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
3-HYDROXY-7-METHYLESTRA-1(10),2,4-TRIEN-17-ONE
(7R,8R,9S,13S,14S)-3-hydroxy-7,13-dimethyl-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one |
| Wiley ID |
4_1451 |
