Account Thielocin B1
- Catalog No. :
- ACBULN726
- CAS No. :
- 144118-26-3
- Molecular Formula :
- C53H58O17
- Molecular Weight :
- 967.03
IUPAC Name:4-((4-((3-(4-((4-carboxy-3-methoxy-2,5,6-trimethylphenoxy)carbonyl)-3-methoxy-2,5,6-trimethylphenoxy)-4,6-dihydroxy-2,5-dimethylbenzoyl)oxy)-2-methoxy-3,5,6-trimethylbenzoyl)oxy)-2-methoxy-3,5,6-trimethylbenzoic acid
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Product Information
| Product Name | Thielocin B1 |
|---|---|
| IUPAC Name | 4-((4-((3-(4-((4-carboxy-3-methoxy-2,5,6-trimethylphenoxy)carbonyl)-3-methoxy-2,5,6-trimethylphenoxy)-4,6-dihydroxy-2,5-dimethylbenzoyl)oxy)-2-methoxy-3,5,6-trimethylbenzoyl)oxy)-2-methoxy-3,5,6-trimethylbenzoic acid |
| Molecular Formula | C53H58O17 |
| Molecular Weight | 967.03 |
| SMILES | O=C(O)C1=C(C)C(C)=C(OC(C2=C(C)C(C)=C(OC(C3=C(O)C(C)=C(O)C(OC4=C(C)C(C)=C(C(OC5=C(C)C(C)=C(C(O)=O)C(OC)=C5C)=O)C(OC)=C4C)=C3C)=O)C(C)=C2OC)=O)C(C)=C1OC |
| InChI Key | BOFISKFABQHONR-UHFFFAOYSA-N |
| Synonym | Benzoic acid, 3-[4-[(4-carboxy-3-methoxy-2,5,6-trimethylphenoxy)carbonyl]-3-methoxy-2,5,6-trimethylphenoxy]-4,6-dihydroxy-2,5-dimethyl-, 1-[4-[(4-carboxy-3-methoxy-2,5,6-trimethylphenoxy)carbonyl]-3-methoxy-2,5,6-trimethylphenyl] ester;Thielocin B1;Thielocin-B1 |
| CAS No. | 144118-26-3 |
Synthetic Route by SureRoute
2. ACBULN726 Molecular Building Block Synthetic Route
4-Formyl-3-hydroxy-8-methoxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-6-carboxylic acid
4-((4-((2,4-Dihydroxy-3,6-dimethylbenzoyl)oxy)-2-methoxy-3,5,6-trimethylbenzoyl)oxy)-2-methoxy-3,5,6-trimethylbenzoic acid
4-((2,4-Dimethoxy-3,6-dimethylbenzoyl)oxy)-2-hydroxy-3,6-dimethylbenzoic acid