| SpectraBase Spectrum ID |
F9nredCgR0x |
| Name |
Estra-1,3,5(10)-trien-17-one, 4-hydroxy-3-methoxy- |
| CAS Registry Number |
5976-62-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H24O3 |
| InChI |
InChI=1S/C19H24O3/c1-19-10-9-12-11-5-7-16(22-2)18(21)14(11)4-3-13(12)15(19)6-8-17(19)20/h5,7,12-13,15,21H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,19+/m1/s1 |
| InChIKey |
XITPEPUPAYFVDV-BFDPJXHCSA-N |
| Molecular Weight |
300.398 g/mol |
| SMILES |
Oc1c2c([C@]3(CC[C@]4([C@]([C@@]3(CC2)[H])(CCC4=O)[H])C)[H])ccc1OC |
| SPLASH |
splash10-0udi-1869000000-2d8db705c5df38425ced |
| Source of Spectrum |
W5-27045-0-0 |
| Synonyms |
(8R,9S,13S,14S)-3-methoxy-13-methyl-4-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
(8R,9S,13S,14S)-4-hydroxy-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
4-Hydroxy-3-methoxy-1,3,5(10)-estratrien-17-one
4-Hydroxyestrone-3-methyl ether
BRN 2509555 |
| Wiley ID |
1303211 |
