| SpectraBase Spectrum ID |
I4cJQfZUlJ2 |
| Name |
4-METHOXY-ESTRA-1,3,5(10)-TRIENE-3,17.BETA.-DIOL-(3,17.BETA.-DI-ACETATE) |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
386.209324061 u |
| Formula |
C23H30O5 |
| InChI |
InChI=1S/C23H30O5/c1-13(24)27-20-9-7-15-16-11-12-23(3)19(8-10-21(23)28-14(2)25)17(16)5-6-18(15)22(20)26-4/h7,9,16-17,19,21H,5-6,8,10-12H2,1-4H3/t16-,17-,19+,21+,23+/m1/s1 |
| InChIKey |
ZMQRFFYIFZWFRE-RHDNAEHESA-N |
| Molecular Weight |
386.488 g/mol |
| Nominal Mass |
386 u |
| Number of Peaks |
101 |
| SMILES |
c1(ccc2[C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CCc2c1OC)[H])[H])(OC(C)=O)[H])C)[H])OC(C)=O |
| SPLASH |
splash10-0006-1329000000-592933bd803677653328 |
| Source File Reference |
LMCM-75787-056M |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
17-(ACETYLOXY)-4-METHOXYESTRA-1(10),2,4-TRIEN-3-YL ACETATE
(8R,9S,13S,14S,17S)-4-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diyl diacetate |
| Wiley ID |
4_1432 |
