| SpectraBase Spectrum ID |
83ldrs2DX8g |
| Name |
7.ALPHA.-METHYL-ESTRA-1,3,5(10)-TRIENE-3,17.BETA.-DIOL |
| CAS Registry Number |
10448-97-2 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
286.193280075 u |
| Formula |
C19H26O2 |
| InChI |
InChI=1S/C19H26O2/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/h3-4,10-11,15-18,20-21H,5-9H2,1-2H3/t11-,15-,16+,17+,18-,19+/m1/s1 |
| InChIKey |
DXWWYJWUFULMAP-JZHXJEGVSA-N |
| Molecular Weight |
286.415 g/mol |
| Nominal Mass |
286 u |
| Number of Peaks |
75 |
| SMILES |
O[C@@]1([C@]2(CC[C@@]3(c4ccc(cc4C[C@]([C@]3([C@@]2(CC1)[H])[H])(C)[H])O)[H])C)[H] |
| SPLASH |
splash10-000i-1890000000-bd6be951c92415a02fc0 |
| Source File Reference |
LMCM-75569-927V |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
7-METHYLESTRA-1(10),2,4-TRIENE-3,17-DIOL
(7R,8R,9S,13S,14S,17S)-7,13-dimethyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
| Wiley ID |
4_1454 |
