Account 4a,7b-dihydroxy-3-(hydroxymethyl)-9a-(isobutyryloxy)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl (E)-2-methylbut-2-enoate
- Catalog No. :
- ACOCPC904
- CAS No. :
- 92214-54-5
- Molecular Formula :
- C29H40O8
- Molecular Weight :
- 516.63
IUPAC Name:4a,7b-dihydroxy-3-(hydroxymethyl)-9a-(isobutyryloxy)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl (E)-2-methylbut-2-enoate
![4a,7b-dihydroxy-3-(hydroxymethyl)-9a-(isobutyryloxy)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl (E)-2-methylbut-2-enoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 4a,7b-dihydroxy-3-(hydroxymethyl)-9a-(isobutyryloxy)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl (E)-2-methylbut-2-enoate |
|---|---|
| IUPAC Name | 4a,7b-dihydroxy-3-(hydroxymethyl)-9a-(isobutyryloxy)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl (E)-2-methylbut-2-enoate |
| MDL No. | MFCD29049464 |
| Molecular Formula | C29H40O8 |
| Molecular Weight | 516.63 |
| SMILES | C/C=C(\C)C(=O)OC1C(C)C2(O)C(C=C(CO)CC3(O)C(=O)C(C)=CC32)C2C(C)(C)C12OC(=O)C(C)C |
| InChI Key | MVWXLRYZCZSBKW-OQLLNIDSSA-N |
| Synonym | 12-O-Tiglylphorbol-13 -isobutyrate;12-O-Tiglylphorbol-13 –isobutyrate(CAS：92214-54-5);12-O-Tiglylphorbol-13 –2-Butenoic acid, 2-methyl-, 1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-9a-(2-methyl-1-oxopropoxy)-5-oxo-1H-cyclopropa[3,4]benz[1,2-e]azulen-9-yl ester, [1aR-[1aα,1bβ,4aβ,7aα,7bα,8α,9β(E),9aα]]- (9CI) |
| CAS No. | 92214-54-5 |
| PubChem CID | 73350378 |
Synthetic Route by SureRoute
2. ACOCPC904 Molecular Building Block Synthetic Route
(1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-9a-Acetoxy-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl tetradecanoate
4Alpha-Phorbol 12-Myristate 13-Acetate
(1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-4a,7b,9-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl acetate