| SpectraBase Spectrum ID |
2kj6Cyd8lo8 |
| Name |
(1S,2S,4aS,10aR)-1-(hydroxymethyl)-7-isopropyl-8-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,5-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O4 |
| InChI |
InChI=1S/C21H32O4/c1-12(2)14-10-15(23)18-13(19(14)25-5)6-7-16-20(18,3)9-8-17(24)21(16,4)11-22/h10,12,16-17,22-24H,6-9,11H2,1-5H3/t16-,17+,20+,21-/m1/s1 |
| InChIKey |
UZFMQGZVASNYID-SQBLYHGDSA-N |
| Molecular Weight |
348.483 g/mol |
| SMILES |
Oc1cc(c(c2c1[C@]1(CC[C@@]([C@@]([C@@]1(CC2)[H])(CO)C)(O)[H])C)OC)C(C)C |
| SPLASH |
splash10-0002-2149000000-d0fb1a9e513d644261df |
| Source of Spectrum |
KC-57-8421-7 |
| Synonyms |
(1S,2S,4aS,10aR)-1-(hydroxymethyl)-8-methoxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-2,5-diol
(1S,2S,4aS,10aR)-7-isopropyl-8-methoxy-1,4a-dimethyl-1-methylol-2,3,4,9,10,10a-hexahydrophenanthrene-2,5-diol |
| Wiley ID |
1626072 |
