| SpectraBase Spectrum ID |
HCwBjngDat1 |
| Name |
1H-7,9a-Methanobenz[a]azulene, gibbane-1,10-dicarboxylic acid deriv. |
| Alternate Name(s) |
Gibbane-1,10-dicarboxylic acid, 7-(acetyloxy)-3-chloro-1,4a-dimethyl-8-methylene-, dimethyl ester, (1.alpha.,3.beta.,4a.beta.,4b.beta.,10.beta.)-
Dimethyl (1alpha,3alpha,4aalpha,4bbeta,10beta)-7-(acetyloxy)-3-chloro-1,4a-dimethyl-8-methylenegibbane-1,10-dicarboxylate
ent-13-acetoxy-2.alpha.-chloro-10.alpha.-gibberell-16-ene-7,19-dioic acid 7,19-dimethyl ester |
| CAS Registry Number |
99221-49-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H33ClO6 |
| InChI |
InChI=1S/C24H33ClO6/c1-13-9-23-12-24(13,31-14(2)26)8-7-16(23)21(3)10-15(25)11-22(4,20(28)30-6)18(21)17(23)19(27)29-5/h15-18H,1,7-12H2,2-6H3/t15-,16+,17-,18+,21+,22-,23?,24?/m1/s1 |
| InChIKey |
XRULJZBFDODFLD-MVNHQANISA-N |
| Molecular Weight |
452.975 g/mol |
| SMILES |
C123[C@]([C@@]4([C@](C(=O)OC)(C[C@@](C[C@]4([C@@]3(CCC(C1)(OC(=O)C)C(C2)=C)[H])C)(Cl)[H])C)[H])(C(=O)OC)[H] |
| SPLASH |
splash10-007o-0119400000-c294d0d963d5d1154d05 |
| Source of Spectrum |
KC-1985-1149-8 |
| Wiley ID |
1388246 |
![1H-7,9a-Methanobenz[a]azulene, gibbane-1,10-dicarboxylic acid deriv.](/api/spectrum/HCwBjngDat1/structure.png?h=300&w=458 "1H-7,9a-Methanobenz[a]azulene, gibbane-1,10-dicarboxylic acid deriv.")
