SpectraBase Spectrum ID |
9DvjVwsjdO4 |
Name |
3,17.BETA.-DIHYDROXY-ESTRA-1,3,5(10)-TRIENE |
CAS Registry Number |
50-28-2 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
272.177630011 u |
Formula |
C18H24O2 |
InChI |
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1 |
InChIKey |
VOXZDWNPVJITMN-ZBRFXRBCSA-N |
Molecular Weight |
272.388 g/mol |
Nominal Mass |
272 u |
Number of Peaks |
60 |
SMILES |
O[C@@]1([C@]2(CC[C@@]3(c4ccc(cc4CC[C@]3([C@@]2(CC1)[H])[H])O)[H])C)[H] |
SPLASH |
splash10-00di-2890000000-b841da8d629d60460775 |
Source File Reference |
LMCM-82581-421K |
Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
Synonyms |
ESTRA-1,3,5(10)-TRIENE-3,17-DIOL (17.BETA.)-
ESTRA-1,3,5(10)-TRIENE-3,17.BETA.-DIOL
ESTRA-1,3,5(10)-TRIENE-3,17-DIOL
ESTRADIOL
DIHYDROFOLLIKULIN
(8R,9S,13S,14S,17S)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
Wiley ID |
4_400 |