| SpectraBase Spectrum ID |
5t71V4k18jn |
| Name |
17a.beta.-Acetoxy-3-methoxy-6-oxa-D-homoestra-1,3,5(10)-triene |
| Alternate Name(s) |
(1S,4aR,10bR)-8-methoxy-12a-methyl-2,3,4,4a,4b,5,10b,11,12,12a-decahydro-1H-naphtho[1,2-c]chromen-1-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H28O4 |
| InChI |
InChI=1S/C21H28O4/c1-13(22)25-20-6-4-5-18-17-12-24-19-11-14(23-3)7-8-16(19)15(17)9-10-21(18,20)2/h7-8,11,15,17-18,20H,4-6,9-10,12H2,1-3H3/t15-,17?,18+,20-,21?/m0/s1 |
| InChIKey |
XMBQGTZXWFAVLH-ZIIVORIMSA-N |
| Molecular Weight |
344.451 g/mol |
| SMILES |
C12([C@@](C3COc4c([C@@]3(CC2)[H])ccc(OC)c4)(CCC[C@@]1(OC(=O)C)[H])[H])C |
| SPLASH |
splash10-01rl-0924000000-7b570b8faa9cda75e985 |
| Source of Spectrum |
O1-34-1298-4 |
| Wiley ID |
819456 |
