Account (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(((4R,4aS,6aR,9S,11aR,11bS)-9-hydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carbonyl)oxy)tetrahydro-2H-pyran-2-carboxylic acid
- Catalog No. :
- ACQUIZ550
- CAS No. :
- 885044-59-7
- Molecular Formula :
- C26H38O9
- Molecular Weight :
- 494.58
IUPAC Name:(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(((4R,4aS,6aR,9S,11aR,11bS)-9-hydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carbonyl)oxy)tetrahydro-2H-pyran-2-carboxylic acid
![(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(((4R,4aS,6aR,9S,11aR,11bS)-9-hydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carbonyl)oxy)tetrahydro-2H-pyran-2-carboxylic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(((4R,4aS,6aR,9S,11aR,11bS)-9-hydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carbonyl)oxy)tetrahydro-2H-pyran-2-carboxylic acid |
|---|---|
| IUPAC Name | (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(((4R,4aS,6aR,9S,11aR,11bS)-9-hydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carbonyl)oxy)tetrahydro-2H-pyran-2-carboxylic acid |
| Molecular Formula | C26H38O9 |
| Molecular Weight | 494.58 |
| SMILES | C=C1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)O[C@@H]4O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]2CC[C@]1(O)C3 |
| InChI Key | UWKMRMSZJBDGGY-MKXZEIDCSA-N |
| Synonym | UWKMRMSZJBDGGY-OEVVWQNPSA-N;β-D-Glucopyranuronic acid, 1-[(4α)-13-hydroxykaur-16-en-18-oate] |
| CAS No. | 885044-59-7 |
Synthetic Route by SureRoute
2. ACQUIZ550 Molecular Building Block Synthetic Route
(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl (9S,11aR,11bS)-4,11b-dimethyl-8-methylene-9-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylate
3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 7-hydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylate
(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl (9S,11aR,11bS)-9-(((2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylate