Account 3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((2S)-5-hydroxy-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid
- Catalog No. :
- ACCXQM194
- CAS No. :
- 246868-97-3
- Molecular Formula :
- C30H50O5
- Molecular Weight :
- 490.73
IUPAC Name:3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((2S)-5-hydroxy-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid
![3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((2S)-5-hydroxy-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((2S)-5-hydroxy-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid |
|---|---|
| IUPAC Name | 3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((2S)-5-hydroxy-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid |
| MDL No. | MFCD20260477 |
| Molecular Formula | C30H50O5 |
| Molecular Weight | 490.73 |
| SMILES | C=C(C)[C@@H]1CC[C@]2(C)[C@H](CC[C@@H]3[C@@H]([C@]4(C)CCC(O)(C(C)(C)O)O4)CC[C@]32C)[C@@]1(C)CCC(=O)O |
| InChI Key | UTPZDJKEZVYWGA-KWGMKSPHSA-N |
| Synonym | Aglinin A;(20S)-24,25-Dihydroxy-20,24-epoxy-3,4-secodammar-4(28)-en-3-oic acid;20S,24-Epoxy-24,25-dihydroxy-3,4-secodammar-4(28)-en-3-oic acid;1H-Benz[e]indene-6-propanoic acid, dodecahydro-6,9a,9b-trimethyl-7-(1-methylethenyl)-3-[(2S,5S)-tetrahydro-5-hydroxy-5-(1-hydroxy-1-methylethyl)-2-methyl-2-furanyl]-, (3S,3aR,5aR,6S,7S,9aR,9bR)- |
| CAS No. | 246868-97-3 |
Synthetic Route by SureRoute
2. ACCXQM194 Molecular Building Block Synthetic Route
3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid
3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid
(2R,3R,5aR,7aS,7bR,9aS,12R,13aR,13bS,15aR,15bS,16R)-2,3-dihydroxy-7b,9a,12,13b,15a,16-hexamethylicosahydro-5H-3,5a-methanochryseno[2,1-c]oxepine-12-carboxylic acid