Account (2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-4,5,11-trihydroxy-4a,8,13,13-tetramethyl-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,9,12b(2aH)-triyl triacetate
- Catalog No. :
- ACFJCN749
- CAS No. :
- 142203-65-4
- Molecular Formula :
- C33H42O12
- Molecular Weight :
- 630.69
IUPAC Name:(2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-4,5,11-trihydroxy-4a,8,13,13-tetramethyl-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,9,12b(2aH)-triyl triacetate
![(2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-4,5,11-trihydroxy-4a,8,13,13-tetramethyl-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,9,12b(2aH)-triyl triacetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-4,5,11-trihydroxy-4a,8,13,13-tetramethyl-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,9,12b(2aH)-triyl triacetate |
|---|---|
| IUPAC Name | (2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-12-(benzoyloxy)-4,5,11-trihydroxy-4a,8,13,13-tetramethyl-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,9,12b(2aH)-triyl triacetate |
| Molecular Formula | C33H42O12 |
| Molecular Weight | 630.69 |
| SMILES | CC(=O)O[C@H]1C[C@@]2(O)[C@@H](OC(=O)C3=CC=CC=C3)[C@@H]3[C@]4(OC(C)=O)CO[C@@H]4C[C@H](O)[C@@]3(C)[C@@H](O)[C@H](OC(C)=O)C(=C1C)C2(C)C |
| InChI Key | WPPPFZJNKLMYBW-FAEUQDRCSA-N |
| Synonym | Cabazitaxel Impurity 55;9-Dideacetyl baccatin VI;2a,3,4,4a,5,6,9,10,12,12a-Decahydro-4a,8,13,13-tetramethyl-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxete-4,5,6,9,11,12,12b-heptol (2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-6,9,12b-triacetate 12-benzoate;13-Acetyl-9-dihydrobaccatin III;9-Dihydro-13-acetylbaccatinIII from Taxus canadensis;9-DIHYDRO-13-ACETYL BACCATIN(9-DHB);7,9-Dideacetylbaccatin VI;19-DHB |
| CAS No. | 142203-65-4 |
Synthetic Route by SureRoute
2. ACFJCN749 Molecular Building Block Synthetic Route
12-(benzoyloxy)-4,5,10,11-tetrahydroxy-4a,8,13,13-tetramethyl-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,9,12b(2aH)-triyl triacetate
12-(benzoyloxy)-4,5,9,10,11-pentahydroxy-4a,8,13,13-tetramethyl-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate
10b-acetoxy-4,5,6,8-tetrahydroxy-9a-(2-hydroxypropan-2-yl)-4a,7-dimethyl-2a,3,4,4a,5,6,8,9,9a,10,10a,10b-dodecahydro-1H-azuleno[5',6':3,4]benzo[1,2-b]oxet-10-yl benzoate