| SpectraBase Spectrum ID |
3uEPVHzHp2I |
| Name |
4-Methylene-A-homo-B,19-di-nor-5.beta.-androst-9-ene-3.beta.,17.beta.-diol dibenzoate |
| Alternate Name(s) |
(3S,9S,10aR)-9-(benzoyloxy)-3a-methyl-10-methylene-2,3,3a,4,5,6,7,8,9,10,10a,11,11a,11b-tetradecahydro-1H-cyclohepta[b]as-indacen-3-yl benzoate
4a-Methyleno-A-homo-B,19-di-nor-5.beta.-androst-9-ene-3.beta.,17.beta.-diol dibenzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H36O4 |
| InChI |
InChI=1S/C33H36O4/c1-21-26-20-27-25(24(26)14-9-15-29(21)36-31(34)22-10-5-3-6-11-22)18-19-33(2)28(27)16-17-30(33)37-32(35)23-12-7-4-8-13-23/h3-8,10-13,26-30H,1,9,14-20H2,2H3/t26-,27?,28?,29-,30-,33?/m0/s1 |
| InChIKey |
MVKGTHQYRYFOIN-GNPHTSKSSA-N |
| Molecular Weight |
496.647 g/mol |
| SMILES |
C12=C3[C@@](C([C@@](OC(=O)c4ccccc4)(CCC3)[H])=C)([H])CC1C1CC[C@@](C1(CC2)C)(OC(=O)c1ccccc1)[H] |
| SPLASH |
splash10-00di-0009400000-4f684e7c5dacb58a1151 |
| Source of Spectrum |
G-56-1082-0 |
| Wiley ID |
748330 |
