| SpectraBase Spectrum ID |
6zDPjXH0tM9 |
| Name |
(1S,4aS,10aR)-7-ethyl-6-hydroxy-1,4a-dimethyl-5-nitro-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester |
| Alternate Name(s) |
Methyl (1S,4aS,10aR)-7-ethyl-1,4a-dimethyl-5-nitro-6-oxidanyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
Methyl (1S,4aS,10aR)-7-ethyl-6-hydroxy-1,4a-dimethyl-5-nitro-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate |
| CAS Registry Number |
128736-96-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27NO5 |
| InChI |
InChI=1S/C20H27NO5/c1-5-12-11-13-7-8-14-19(2,15(13)16(17(12)22)21(24)25)9-6-10-20(14,3)18(23)26-4/h11,14,22H,5-10H2,1-4H3/t14-,19+,20+/m1/s1 |
| InChIKey |
VDWFSLFRJDUHAJ-UAOJZALGSA-N |
| Molecular Weight |
361.438 g/mol |
| SMILES |
Oc1c(c2[C@@]3([C@@]([C@](C(=O)OC)(C)CCC3)([H])CCc2cc1CC)C)N(=O)=O |
| SPLASH |
splash10-014l-0095000000-c154521570413193c8af |
| Source of Spectrum |
B-43-500-33 |
| Wiley ID |
1349010 |
