Account Fasciculic acid B
- Catalog No. :
- ACICUM678
- CAS No. :
- 126882-55-1
- Molecular Formula :
- C36H60O9
- Molecular Weight :
- 636.87
IUPAC Name:5-(((2R,3R,5R,10S,12S,13R,14S,17R)-17-((2R,5R)-5,6-dihydroxy-6-methylheptan-2-yl)-3,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl)oxy)-3-hydroxy-3-methyl-5-oxopentanoic acid
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Product Information
| Product Name | Fasciculic acid B |
|---|---|
| IUPAC Name | 5-(((2R,3R,5R,10S,12S,13R,14S,17R)-17-((2R,5R)-5,6-dihydroxy-6-methylheptan-2-yl)-3,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl)oxy)-3-hydroxy-3-methyl-5-oxopentanoic acid |
| Molecular Formula | C36H60O9 |
| Molecular Weight | 636.87 |
| SMILES | C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)C3=C(C[C@H](O)[C@]12C)[C@@]1(C)C[C@@H](OC(=O)CC(C)(O)CC(=O)O)[C@H](O)C(C)(C)[C@@H]1CC3 |
| InChI Key | SWRXIGFQDQTNKP-PEEMPJFVSA-N |
| Synonym | fasciculic acid B;4-Carboxylato-3-hydroxy-3-methylbutanoic acid (24R)-3β,12α,24,25-tetrahydroxy-5α-lanost-8-en-2α-yl ester;Lanost-8-ene-2,3,12,24,25-pentol, 2-(hydrogen 3-hydroxy-3-methylpentanedioate), (2α,3β,12α,24R)- |
| CAS No. | 126882-55-1 |
Synthetic Route by SureRoute
2. ACICUM678 Molecular Building Block Synthetic Route
Fasciculic acid A
(3S,8R,9S,10R,11S,12S,13S,14S,17S)-11-acetoxy-17-acetyl-3,14-dihydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-12-yl 3-methylbutanoate
(3S,4aR,5S,6R,6aR,10R,10aS,10bR)-10-(isobutyryloxy)-4a,6a,7,10b-tetramethyl-5'-oxo-1,2,4a,4',5,5',6,6a,9,10,10a,10b-dodecahydro-2'H-spiro[benzo[f]chromene-3,3'-furan]-5,6-diyl diacetate