Account (6aR,6bR,8aR,8bR,9S,12S,13aR,14aS,14bS)-5-hydroxy-12-(2-hydroxypropan-2-yl)-3,3,6b,8a,9,14a-hexamethyl-6a,6b,8,8a,8b,9,11,12,13a,14,14a,14b-dodecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]oxepine-4,7,10(3H)-trione
- Catalog No. :
- ACCUNL153
- CAS No. :
- 60137-06-6
- Molecular Formula :
- C30H42O6
- Molecular Weight :
- 498.66
IUPAC Name:(6aR,6bR,8aR,8bR,9S,12S,13aR,14aS,14bS)-5-hydroxy-12-(2-hydroxypropan-2-yl)-3,3,6b,8a,9,14a-hexamethyl-6a,6b,8,8a,8b,9,11,12,13a,14,14a,14b-dodecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]oxepine-4,7,10(3H)-trione
![(6aR,6bR,8aR,8bR,9S,12S,13aR,14aS,14bS)-5-hydroxy-12-(2-hydroxypropan-2-yl)-3,3,6b,8a,9,14a-hexamethyl-6a,6b,8,8a,8b,9,11,12,13a,14,14a,14b-dodecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]oxepine-4,7,10(3H)-trione structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (6aR,6bR,8aR,8bR,9S,12S,13aR,14aS,14bS)-5-hydroxy-12-(2-hydroxypropan-2-yl)-3,3,6b,8a,9,14a-hexamethyl-6a,6b,8,8a,8b,9,11,12,13a,14,14a,14b-dodecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]oxepine-4,7,10(3H)-trione |
|---|---|
| IUPAC Name | (6aR,6bR,8aR,8bR,9S,12S,13aR,14aS,14bS)-5-hydroxy-12-(2-hydroxypropan-2-yl)-3,3,6b,8a,9,14a-hexamethyl-6a,6b,8,8a,8b,9,11,12,13a,14,14a,14b-dodecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]oxepine-4,7,10(3H)-trione |
| Molecular Formula | C30H42O6 |
| Molecular Weight | 498.66 |
| SMILES | C[C@@H]1C(=O)C[C@@H](C(C)(C)O)O[C@@H]2C[C@@]3(C)[C@@H]4CC=C5[C@@H](C=C(O)C(=O)C5(C)C)[C@]4(C)C(=O)C[C@]3(C)[C@@H]12 |
| InChI Key | MBYLRWSUZLFUTO-PQNVQGKDSA-N |
| Synonym | (10α,24S)-16α,24-Epoxy-2,25-dihydroxy-9β-methyl-19-norlanosta-1,5-diene-3,11,22-trione;19-Norlanosta-1,5-diene-3,11,22-trione, 16,24-epoxy-2,25-dihydroxy-9-methyl-, (9beta,10alpha,16alpha,24S)-;19-Norlanosta-1,5-diene-3,11,22-trione, 16,24-epoxy-2,25-dihydroxy-9-methyl-, (9β,10α,16α,24S)-;(4R,9beta,16alpha,24S)-2,25-dihydroxy-9,10,14-trimethyl-16,2...;cucuritacin IIa |
| CAS No. | 60137-06-6 |
Synthetic Route by SureRoute
2. ACCUNL153 Molecular Building Block Synthetic Route
(R,E)-6-((8S,9R,10R,13R,14S,16R,17R)-2,16-Dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-4,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl acetate
(1R,2aR,3aR,3bR,9aR,9bR,11aS)-5-hydroxy-3b,6,6,9a,11a-pentamethyl-1-(2-oxo-2,5-dihydro-1H-pyrrol-3-yl)-1,2,2a,9a,9b,10,11,11a-octahydronaphtho[1',2':6,7]indeno[1,7a-b]oxirene-4,7(3bH,6H)-dione
(1R,2R,5S,5aR,10aR,10bS,11R)-1-hydroxy-5a,8,10a,11-tetramethyl-5,5a,10a,10b-tetrahydro-2H-2,5-methanoindeno[4,5-d]oxepine-4,6,10(1H)-trione