Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-(dihydrogen phosphate)
CAS Registry Number®
4995-43-1
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CAS Name
Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-(dihydrogen phosphate)Molecular Formula
C18H25O5PMolecular Mass
352.36Cite this Page
Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-(dihydrogen phosphate). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=4995-43-1 (retrieved ) (CAS RN: 4995-43-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C18H25O5P/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)23-24(20,21)22/h3,5,10,14-17,19H,2,4,6-9H2,1H3,(H2,20,21,22)/t14-,15-,16+,17+,18+/m1/s1
InChIKey
InChIKey=BBWXLCKRYRQQPL-ZBRFXRBCSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(O)=CC4)(CC1)[H])[H])(CC[C@@H]2OP(=O)(O)O)[H]
Canonical SMILES
O=P(O)(O)OC1CCC2C3CCC4=CC(O)=CC=C4C3CCC12C
Other Names for this Substance
- Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-(dihydrogen phosphate)
- Estradiol, 17-(dihydrogen phosphate)
- Estradiol 17β-phosphate
- Estradiol 17-phosphate
