Account (R)-4-((3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
- Catalog No. :
- ACDWHG491
- CAS No. :
- 459789-99-2
- Molecular Formula :
- C26H44O4
- Molecular Weight :
- 420.63
IUPAC Name:(R)-4-((3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
![(R)-4-((3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (R)-4-((3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid |
|---|---|
| IUPAC Name | (R)-4-((3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid |
| MDL No. | MFCD16621104 |
| Molecular Formula | C26H44O4 |
| Molecular Weight | 420.63 |
| SMILES | C[C@]12CC[C@H](C[C@@]1([H])[C@H]([C@H]([C@]([H])1[C@@]([H])3CC[C@@]([H])([C@]3(CC[C@@]12[H])C)[C@H](C)CCC(=O)O)O)CC)O |
| InChI Key | ZXERDUOLZKYMJM-ZWECCWDJSA-N |
| Synonym | 6-ECDCA | INT-747 | 6-Ethylchenodeoxycholic acid | 6-Ethyl-3α,7α-dihydroxycholan-24-oic Acid | OCA | (3α,5β, 6α,7α)-6-ethyl-3,7-dihydroxy-cholan-24-oic acid | 6a-Ethyl-Chenodeoxycholic Acid |
| CAS No. | 459789-99-2 |
| PubChem CID | 447715 |
Synthetic Route by SureRoute
2. ACDWHG491 Molecular Building Block Synthetic Route
(R)-4-((3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
(R)-4-((3S,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
(R)-4-((3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-Dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid