Estra-1,3,5(10)-triene-3,16,17-triol, 17-(dihydrogen phosphate), (16α,17β)-
CAS Registry Number®
35973-57-0
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CAS Name
Estra-1,3,5(10)-triene-3,16,17-triol, 17-(dihydrogen phosphate), (16α,17β)-Molecular Formula
C18H25O6PMolecular Mass
368.36Cite this Page
Estra-1,3,5(10)-triene-3,16,17-triol, 17-(dihydrogen phosphate), (16α,17β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=35973-57-0 (retrieved ) (CAS RN: 35973-57-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C18H25O6P/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)24-25(21,22)23/h3,5,8,13-17,19-20H,2,4,6-7,9H2,1H3,(H2,21,22,23)/t13-,14-,15+,16-,17+,18+/m1/s1
InChIKey
InChIKey=HNKVQSMSAFUELQ-ZXXIGWHRSA-N
SMILES
C[C@@]12[C@]([C@]3([C@](CC1)(C=4C(CC3)=CC(O)=CC4)[H])[H])(C[C@@H](O)[C@@H]2OP(=O)(O)O)[H]
Canonical SMILES
O=P(O)(O)OC1C(O)CC2C3CCC4=CC(O)=CC=C4C3CCC12C
Other Names for this Substance
- Estra-1,3,5(10)-triene-3,16,17-triol, 17-(dihydrogen phosphate), (16α,17β)-
- Estriol phosphate
