Account SK&F 104976
- Catalog No. :
- ACCJXL534
- CAS No. :
- 136209-43-3
- Molecular Formula :
- C31H50O3
- Molecular Weight :
- 470.74
IUPAC Name:2-((3S,5R,10S,13R,14R,17S)-3-hydroxy-4,4,10,13-tetramethyl-17-((R)-6-methylheptan-2-yl)-1,2,3,4,5,6,7,10,11,12,13,17-dodecahydro-14H-cyclopenta[a]phenanthren-14-yl)acetic acid
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Product Information
| Product Name | SK&F 104976 |
|---|---|
| IUPAC Name | 2-((3S,5R,10S,13R,14R,17S)-3-hydroxy-4,4,10,13-tetramethyl-17-((R)-6-methylheptan-2-yl)-1,2,3,4,5,6,7,10,11,12,13,17-dodecahydro-14H-cyclopenta[a]phenanthren-14-yl)acetic acid |
| Molecular Formula | C31H50O3 |
| Molecular Weight | 470.74 |
| SMILES | CC(C)CCC[C@@H](C)[C@H]1C=C[C@@]2(CC(=O)O)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3 |
| InChI Key | AUNLCWKHCZCMHW-HZAPIMJMSA-N |
| Synonym | SK&F 104976;Lanosta-8,15-diene-30-carboxylic acid, 3-hydroxy-, (3β)- |
| CAS No. | 136209-43-3 |
Synthetic Route by SureRoute
2. ACCJXL534 Molecular Building Block Synthetic Route
(4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-3,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-hexadecahydropicene-4a(4H)-carboxylic acid
10-hydroxy-2-(hydroxymethyl)-1,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
(1S,2R,4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-Hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid