| SpectraBase Spectrum ID |
1v6L954SF7G |
| Name |
1H-3,6a-Methanocyclopent[c]oxocin-4-carboxylic acid, 7-(1,5-dimethyl-4-hexenyl)-3,6,7,8,9,9a-hexahydro-, [3R-[3.alpha.,6a.alpha.,7.beta.(R*),9a.beta.]]- |
| Alternate Name(s) |
(1R,2S,5S,8R)-2-(1,5-dimethyl-4-hexenyl)-7-oxatricyclo[6.3.1.0(1,5)]dodec-9-ene-9-carboxylic acid
4-Methoxycarbonyl-10-(1,5-dimethyl-4-hexenyl)-12-oxa-tricyclo[6.3.1(1,5).0(1,7)]dodec-3-ene |
| CAS Registry Number |
110642-45-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O3 |
| InChI |
InChI=1S/C20H30O3/c1-13(2)5-4-6-14(3)17-8-7-15-12-23-18-11-20(15,17)10-9-16(18)19(21)22/h5,9,14-15,17-18H,4,6-8,10-12H2,1-3H3,(H,21,22)/t14?,15-,17+,18-,20+/m1/s1 |
| InChIKey |
ORXNZMGZJPCWEK-PBMFIKAGSA-N |
| Molecular Weight |
318.457 g/mol |
| SMILES |
OC(C=1[C@]2(C[C@]3(CC1)[C@@](CC[C@]3([H])CO2)(C(CCC=C(C)C)C)[H])[H])=O |
| SPLASH |
splash10-0671-4900000000-8ad8bf5c72c0a2fc58b0 |
| Source of Spectrum |
B-39-2117-7 |
| Wiley ID |
1318798 |
![1H-3,6a-Methanocyclopent[c]oxocin-4-carboxylic acid, 7-(1,5-dimethyl-4-hexenyl)-3,6,7,8,9,9a-hexahydro-, [3R-[3.alpha.,6a.alpha.,7.beta.(R*),9a.beta.]]-](/api/spectrum/1v6L954SF7G/structure.png?h=300&w=458 "1H-3,6a-Methanocyclopent[c]oxocin-4-carboxylic acid, 7-(1,5-dimethyl-4-hexenyl)-3,6,7,8,9,9a-hexahydro-, [3R-[3.alpha.,6a.alpha.,7.beta.(R*),9a.beta.]]-")
