| SpectraBase Spectrum ID |
1GZazoqF22G |
| Name |
16.BETA.-(ACETYLOXY)-17.BETA.-METHOXYESTRA-1(10),2,4-TRIEN-3-YL 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)27-16-6-8-17-15(11-16)5-7-19-18(17)9-10-23(3)20(19)12-21(22(23)26-4)28-14(2)25/h6,8,11,18-22H,5,7,9-10,12H2,1-4H3/t18?,19?,20?,21-,22-,23-/m0/s1 |
| InChIKey |
OUMPIODHQWEARZ-ZKPFAEEDSA-N |
| Molecular Weight |
386.488 g/mol |
| Nominal Mass |
386 u |
| Number of Peaks |
90 |
| SMILES |
C(C)(=O)Oc1ccc2C3CC[C@@]4([C@]([C@](CC4C3CCc2c1)(OC(=O)C)[H])(OC)[H])C |
| SPLASH |
splash10-0006-2559000000-9697590c62bdd5edb0c4 |
| Source File Reference |
LMCM-45695-564S |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
17-METHYLETHER-ESTRA-1,3,5(10)-TRIENE-3,16.BETA.-17.BETA.-TRIOL-(3,16.BETA.-DI-ACETATE)
(13S,16S,17R)-17-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,16-diyl diacetate |
| Wiley ID |
4_1421 |
