Account 3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((S)-2-Hydroxy-6-methylhept-5-en-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid
- Catalog No. :
- ACELIP790
- CAS No. :
- 34336-09-9
- Molecular Formula :
- C30H50O3
- Molecular Weight :
- 458.73
IUPAC Name:3-((3S,3aR,5aR,6S,7S,9aR,9bR)-3-((S)-2-hydroxy-6-methylhept-5-en-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-((S)-2-Hydroxy-6-methylhept-5-en-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-((S)-2-Hydroxy-6-methylhept-5-en-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-((S)-2-hydroxy-6-methylhept-5-en-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)dodecahydro-1H-cyclopenta[a]naphthalen-6-yl)propanoic acid |
| MDL No. | MFCD14635405 |
| Molecular Formula | C30H50O3 |
| Molecular Weight | 458.73 |
| SMILES | C[C@]12[C@@]3(C)[C@@]([C@](CCC(O)=O)(C)[C@H](C(C)=C)CC3)(CC[C@@]1([C@@]([C@@](CCC=C(C)C)(C)O)(CC2)[H])[H])[H] |
| InChI Key | SITSHJMXTJRDSK-HPNZNPLMSA-N |
| Synonym | 20-Hydroxy-3,4-seco-5α-dammara-4(28),24-dien-3-oic acid;Dammarenolic acid |
| CAS No. | 34336-09-9 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACELIP790 Molecular Building Block Synthetic Route
(3S,5R,8R,9R,10R,12R,13R,14R,17S)-17-((E)-6-hydroxy-6-methylhept-2-en-2-yl)-4,4,8,10,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol
(4R,4aS,6aS,9R,11aS,11bR)-11a-hydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-Hydroxy-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid