| SpectraBase Spectrum ID |
2R21MasOmQU |
| Name |
11H-Cyclopenta[a]phenanthrene-15-carboxylic acid, 12,13,16,17-tetrahydro-17-hydroxy-3-methoxy-13-methyl-, (13S-cis)- |
| CAS Registry Number |
56588-57-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H20O4 |
| InChI |
InChI=1S/C20H20O4/c1-20-8-7-14-13-6-4-12(24-2)9-11(13)3-5-15(14)18(20)16(19(22)23)10-17(20)21/h3-6,9,17,21H,7-8,10H2,1-2H3,(H,22,23)/t17-,20+/m0/s1 |
| InChIKey |
NOWHEHTXMQNLNS-FXAWDEMLSA-N |
| Molecular Weight |
324.376 g/mol |
| SMILES |
O[C@@]1([C@]2(CCc3c(C2=C(C(=O)O)C1)ccc1cc(ccc31)OC)C)[H] |
| SPLASH |
splash10-00di-1369000000-8fcfa45b2369627ceead |
| Source of Spectrum |
SD-1981-0-0 |
| Synonyms |
(17beta)-17-hydroxy-3-methoxyestra-1(10),2,4,6,8,14-hexaene-15-carboxylic acid |
| Wiley ID |
1323413 |
![11H-Cyclopenta[a]phenanthrene-15-carboxylic acid, 12,13,16,17-tetrahydro-17-hydroxy-3-methoxy-13-methyl-, (13S-cis)-](/api/spectrum/2R21MasOmQU/structure.png?h=300&w=458 "11H-Cyclopenta[a]phenanthrene-15-carboxylic acid, 12,13,16,17-tetrahydro-17-hydroxy-3-methoxy-13-methyl-, (13S-cis)-")
