SpectraBase Spectrum ID |
8587cQattQV |
Name |
Ethyl 13-(3'-methoxy-17',17'-ethylidenedioxy1',3',5'(10')-estratrien-15'(.alpha.,beta.)-yl)-tridecanoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C36H56O5 |
InChI |
InChI=1S/C36H56O5/c1-4-39-33(37)16-14-12-10-8-6-5-7-9-11-13-15-28-26-36(40-23-24-41-36)35(2)22-21-31-30-20-18-29(38-3)25-27(30)17-19-32(31)34(28)35/h18,20,25,28,31-32,34H,4-17,19,21-24,26H2,1-3H3/t28-,31+,32+,34-,35-/m0/s1 |
InChIKey |
FCHCIGKCTBWWJB-MJPWCBNXSA-N |
Molecular Weight |
568.839 g/mol |
SMILES |
C12([C@@]3([C@@]([C@@]4(CCc5c([C@]4(CC3)[H])ccc(OC)c5)[H])([H])[C@](C1)(CCCCCCCCCCCCC(=O)OCC)[H])C)OCCO2 |
SPLASH |
splash10-000i-0009000000-5a22c59de3983e8c7297 |
Source of Spectrum |
F-47-7762-21 |
Synonyms |
Ethyl 13-[(1'S,10'R,11'S,12'S,15'S)-5'-methoxy-15'-methylspiro[1,3-dioxolane-2,14'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-2'(7'),3',5'-trien-12'-yl]tridecanoate |
Wiley ID |
1407574 |