SpectraBase Spectrum ID |
13egOP8Qrij |
Name |
ESTRA-1,3,5(10)-TRIENE-3-OL-17-ONE |
Alternate Name(s) |
ESTRA-1,3,5(10)-TRIEN-17-ONE, 3-HYDROXY-
ESTRONE
3-HYDROXYESTRA-1,3,5(10)-TRIEN-17-ONE |
CAS Registry Number |
53-16-7 |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C18H22O2 |
InChI |
InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3 |
InChIKey |
DNXHEGUUPJUMQT-UHFFFAOYSA-N |
Nominal Mass |
270 u |
Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
SMILES |
CC12C(=O)CCC2C2CCc3cc(ccc3C2CC1)O |
SPLASH |
splash10-00di-2890000000-af19d7397637fc5ae779 |
Source File Reference |
LMCM-72672-796M |
Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |