| SpectraBase Spectrum ID |
B1Z04RUEa5g |
| Name |
1-Naphthaleneacetic acid, 3-bromodecahydro-5-(methoxycarbonyl)-5,8a-dimethyl-2-oxo-, [1R-(1.alpha.,3.beta.,4a.beta.,5.alpha.,8a.alpha.)]- |
| CAS Registry Number |
81757-84-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H23BrO5 |
| InChI |
InChI=1S/C16H23BrO5/c1-15-5-4-6-16(2,14(21)22-3)11(15)8-10(17)13(20)9(15)7-12(18)19/h9-11H,4-8H2,1-3H3,(H,18,19)/t9-,10+,11-,15-,16+/m0/s1 |
| InChIKey |
ZRJKHPWULVIPLS-SXOZOCIKSA-N |
| Molecular Weight |
375.259 g/mol |
| SMILES |
OC(C[C@@]1([C@]2([C@@]([C@@](C(=O)OC)(C)CCC2)(C[C@](C1=O)(Br)[H])[H])C)[H])=O |
| SPLASH |
splash10-00vj-0790000000-ce559e9eb9f3de9234fd |
| Source of Spectrum |
B-35-189-0 |
| Synonyms |
19-Methyl hydrogen ester of 7.alpha.-bromo-8-oxo-13,14,15,16,17-pentanorlabdane-12,19-dioic acid
[(1R,3R,4aS,5R,8aR)-3-bromo-5-(methoxycarbonyl)-5,8a-dimethyl-2-oxodecahydro-1-naphthalenyl]acetic acid |
| Wiley ID |
1356396 |
![1-Naphthaleneacetic acid, 3-bromodecahydro-5-(methoxycarbonyl)-5,8a-dimethyl-2-oxo-, [1R-(1.alpha.,3.beta.,4a.beta.,5.alpha.,8a.alpha.)]-](/api/spectrum/B1Z04RUEa5g/structure.png?h=300&w=458 "1-Naphthaleneacetic acid, 3-bromodecahydro-5-(methoxycarbonyl)-5,8a-dimethyl-2-oxo-, [1R-(1.alpha.,3.beta.,4a.beta.,5.alpha.,8a.alpha.)]-")
