| SpectraBase Spectrum ID |
5o8qFk2PNEL |
| Name |
Estra-1,3,5(10)-trien-17-ol, 3-(phenylmethoxy)-16-(2-propenyl)-, (16.alpha.,17.beta.)- |
| CAS Registry Number |
106139-63-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H34O2 |
| InChI |
InChI=1S/C28H34O2/c1-3-7-21-17-26-25-12-10-20-16-22(30-18-19-8-5-4-6-9-19)11-13-23(20)24(25)14-15-28(26,2)27(21)29/h3-6,8-9,11,13,16,21,24-27,29H,1,7,10,12,14-15,17-18H2,2H3/t21-,24-,25-,26+,27+,28+/m1/s1 |
| InChIKey |
MPMKDERJUDLROP-YWJGSQKRSA-N |
| Molecular Weight |
402.578 g/mol |
| SMILES |
O[C@@]1([C@@]2([C@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(OCc2ccccc2)c4)[H])(C[C@]1(CC=C)[H])[H])C)[H] |
| SPLASH |
splash10-0006-9100200000-aec7753c30c04a06a804 |
| Source of Spectrum |
J-52-250-7 |
| Synonyms |
(16alpha,17beta)-16-allyl-3-(benzyloxy)estra-1,3,5(10)-trien-17-ol
16.alpha.-allyl-3-(benzyloxy)estra-1,3,5(10)-trien-17.beta.-ol
(8R,9S,13S,14S,16R,17S)-16-allyl-3-benzyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
(8R,9S,13S,14S,16R,17S)-13-methyl-3-phenylmethoxy-16-prop-2-enyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol |
| Wiley ID |
1370714 |
