OBACUNOIC ACID
3-[11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]prop-2-enoic acid
Also Known As: OBACUNOIC ACID
CAS: 751-29-1
| Molecular Formula | C26H32O8 |
|---|---|
| Molecular Weight | 472.20972 g/mol |
| LogP | 3.4447 |
| Topological Polar Surface Area | 126.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.20972 |
| Monoisotopic Mass | 472.20972 |
| Heavy Atoms | 34 |
| Complexity | 1082.7742 |
Chemical Identifiers
| CAS Number | 751-29-1 |
|---|---|
| SMILES | CC12CCC3C(C(CC(=O)C3(C14C(O4)C(=O)OC2C5=COC=C5)C)C(C)(C)O)(C)C=CC(=O)O |
Product Overview
OBACUNOIC ACID (CAS 751-29-1), with molecular formula C26H32O8 and molecular weight 472.20972 g/mol. IUPAC: 3-[11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]prop-2-enoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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