| SpectraBase Spectrum ID |
1wAMKCqt4sn |
| Name |
11H-Cyclopenta[a]phenanthrene-15-carboxylic acid, 12,13,16,17-tetrahydro-17-hydroxy-3-methoxy-13-methyl-, methyl ester, (13S-cis)- |
| Alternate Name(s) |
Methyl (17beta)-17-hydroxy-3-methoxyestra-1(10),2,4,6,8,14-hexaene-15-carboxylate |
| CAS Registry Number |
56588-55-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22O4 |
| InChI |
InChI=1S/C21H22O4/c1-21-9-8-15-14-7-5-13(24-2)10-12(14)4-6-16(15)19(21)17(11-18(21)22)20(23)25-3/h4-7,10,18,22H,8-9,11H2,1-3H3/t18-,21+/m0/s1 |
| InChIKey |
KTNJLPDFVNLIFG-GHTZIAJQSA-N |
| Molecular Weight |
338.403 g/mol |
| SMILES |
O[C@@]1([C@@]2(C(=C(C1)C(=O)OC)c1c(c3ccc(cc3cc1)OC)CC2)C)[H] |
| SPLASH |
splash10-000i-0249000000-5b421eb22ccb6389de5b |
| Source of Spectrum |
SD-1981-0-0 |
| Wiley ID |
1333974 |
![11H-Cyclopenta[a]phenanthrene-15-carboxylic acid, 12,13,16,17-tetrahydro-17-hydroxy-3-methoxy-13-methyl-, methyl ester, (13S-cis)-](/api/spectrum/1wAMKCqt4sn/structure.png?h=300&w=458 "11H-Cyclopenta[a]phenanthrene-15-carboxylic acid, 12,13,16,17-tetrahydro-17-hydroxy-3-methoxy-13-methyl-, methyl ester, (13S-cis)-")
