| SpectraBase Spectrum ID |
GfCQ5poYQxi |
| Name |
1-Naphthaleneacetic acid, 3-bromodecahydro-5-(methoxycarbonyl)-5,8a-dimethyl-2-oxo-, methyl ester, [1R-(1.alpha.,3.beta.,4a.beta.,5.alpha.,8a.alpha.)]- |
| Alternate Name(s) |
Dimethyl ester of 7.alpha.-bromo-8-oxo-13,14,15,16,17-pentanorlabdane-12,19-dioic acid
Methyl (1R,4aS,5R,7R,8aR)-7-bromo-5-(2-methoxy-2-oxoethyl)-1,4a-dimethyl-6-oxodecahydro-1-naphthalenecarboxylate |
| CAS Registry Number |
81757-85-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H25BrO5 |
| InChI |
InChI=1S/C17H25BrO5/c1-16-6-5-7-17(2,15(21)23-4)12(16)9-11(18)14(20)10(16)8-13(19)22-3/h10-12H,5-9H2,1-4H3/t10-,11+,12+,16+,17+/m0/s1 |
| InChIKey |
HLCKTVWCDYCNCY-NMQUUSDXSA-N |
| Molecular Weight |
389.286 g/mol |
| SMILES |
[C@@]12([C@]([C@@](C(=O)OC)(C)CCC2)(C[C@](C([C@@]1(CC(=O)OC)[H])=O)(Br)[H])[H])C |
| SPLASH |
splash10-056r-0098000000-65d7c49dae1605d26aa1 |
| Source of Spectrum |
B-35-190-0 |
| Wiley ID |
1363628 |
![1-Naphthaleneacetic acid, 3-bromodecahydro-5-(methoxycarbonyl)-5,8a-dimethyl-2-oxo-, methyl ester, [1R-(1.alpha.,3.beta.,4a.beta.,5.alpha.,8a.alpha.)]-](/api/spectrum/GfCQ5poYQxi/structure.png?h=300&w=458 "1-Naphthaleneacetic acid, 3-bromodecahydro-5-(methoxycarbonyl)-5,8a-dimethyl-2-oxo-, methyl ester, [1R-(1.alpha.,3.beta.,4a.beta.,5.alpha.,8a.alpha.)]-")
