AC1L882W
2,6-dimethyl-12-propan-2-yl-13,14-dioxatetracyclo[10.2.2.01,10.02,7]hexadec-10-ene-6-carboxylic acid
Also Known As: 9,13-Epidioxy-8(14)-abieten-18-oic acid|9alpha13alpha-Epidioxyabiet-8(14)-en-18-oic Acid|9?,13?-Epidioxyabiet-8(14)-en-18-oic acid|9|_,13|_-Epidioxyabiet-8(14)-en-18-oic acid|9alpha,13alpha-epidioxyabiet-8(14)-en-18-oic acid|3H-3,10b-Ethanonaphtho(1,2-c)-1,2-dioxin-7-carboxylic acid, 5,6,6a,7,8,9,10,10a-octahydro-7,10a-dimethyl-3-(1-methylethyl)-|abieta-8(14)-en-18-oic acid 9alpha,13alpha-endoperoxide|(1R,2S,6R,7R,12R)-2,6-dimethyl-12-propan-2-yl-13,14-dioxatetracyclo[10.2.2.0^{1,10.0^{2,7]hexadec-10-ene-6-carboxylic acid|4b,8-Dimethyl-2-(propan-2-yl)-3,4,4b,5,6,7,8,8a,9,10-decahydro-2H-2,4a-epidioxyphenanthrene-8-carboxylic acid
| Molecular Formula | C20H30O4 |
|---|---|
| Molecular Weight | 334.21442 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 334.21442 |
| Monoisotopic Mass | 334.21442 |
| Heavy Atoms | 24 |
| Complexity | 611.0 |
Chemical Identifiers
| CAS Number | 5309-35-3 |
|---|---|
| SMILES | CC(C)C12CCC3(C(=C1)CCC4C3(CCCC4(C)C(=O)O)C)OO2 |
| InChIKey | OOHFJWCHEFCJDC-UHFFFAOYSA-N |
Product Overview
AC1L882W (CAS 5309-35-3), with molecular formula C20H30O4 and molecular weight 334.21442 g/mol. IUPAC: 2,6-dimethyl-12-propan-2-yl-13,14-dioxatetracyclo[10.2.2.01,10.02,7]hexadec-10-ene-6-carboxylic acid.
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