Account (4R,4aS,5S,6aR,9S,11bR)-5,9-dihydroxy-4,11b-dimethyl-8-methylene-7-oxo-1,2,3,4,4a,5,6,7,8,9,10,11b-dodecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid
- Catalog No. :
- ACAOUA497
- CAS No. :
- 1401419-85-9
- Molecular Formula :
- C20H26O5
- Molecular Weight :
- 346.42
IUPAC Name:(4R,4aS,5S,6aR,9S,11bR)-5,9-dihydroxy-4,11b-dimethyl-8-methylene-7-oxo-1,2,3,4,4a,5,6,7,8,9,10,11b-dodecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid
![(4R,4aS,5S,6aR,9S,11bR)-5,9-dihydroxy-4,11b-dimethyl-8-methylene-7-oxo-1,2,3,4,4a,5,6,7,8,9,10,11b-dodecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (4R,4aS,5S,6aR,9S,11bR)-5,9-dihydroxy-4,11b-dimethyl-8-methylene-7-oxo-1,2,3,4,4a,5,6,7,8,9,10,11b-dodecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid |
|---|---|
| IUPAC Name | (4R,4aS,5S,6aR,9S,11bR)-5,9-dihydroxy-4,11b-dimethyl-8-methylene-7-oxo-1,2,3,4,4a,5,6,7,8,9,10,11b-dodecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid |
| MDL No. | MFCD22200622 |
| Molecular Formula | C20H26O5 |
| Molecular Weight | 346.42 |
| SMILES | C=C1C(=O)[C@@]23C[C@H](O)[C@@H]4[C@](C)(C(=O)O)CCC[C@@]4(C)C2=CC[C@]1(O)C3 |
| InChI Key | QHDAFFWLZDOSSY-ZQWMEVDHSA-N |
| Synonym | Pterisolic acid A;(4alpha,6alpha)-6,13-Dihydroxy-15-oxokaura-9(11),16-dien-18-oic acid;Kaura-9(11),16-dien-18-oic acid, 6,13-dihydroxy-15-oxo-, (4α,6α)- |
| CAS No. | 1401419-85-9 |
Synthetic Route by SureRoute
2. ACAOUA497 Molecular Building Block Synthetic Route
(4R,4aS,6aR,9S,11bR)-9-hydroxy-4,11b-dimethyl-8-methylene-7-oxo-1,2,3,4,4a,5,6,7,8,9,10,11b-dodecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid
(6S)-6-hydroxy-2-methyl-4-oxo-6-((3S,5R,7S,10S,12S,13R,14R,17S)-3,7,12-trihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptanoic acid
6-((3S,5R,7S,10S,13R,14R,17S)-3,7-dihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-4-oxoheptanoic acid