Account (3'R,3''S,4S,4''R,5R,5'S,10S,13S,14S,17S)-3''-hydroxy-4-(hydroxymethyl)-3',4,4'',10,13,14-hexamethyl-1,3',3'',4,4',4'',5,6,7,10,11,12,13,14,15,16-hexadecahydro-5''H-dispiro[cyclopenta[a]phenanthrene-17,2'-furan-5',2''-furan]-3,5''(2H)-dione
- Catalog No. :
- ACSYPI614
- CAS No. :
- 2023822-40-2
- Molecular Formula :
- C30H44O6
- Molecular Weight :
- 500.68
IUPAC Name:(3'R,3''S,4S,4''R,5R,5'S,10S,13S,14S,17S)-3''-hydroxy-4-(hydroxymethyl)-3',4,4'',10,13,14-hexamethyl-1,3',3'',4,4',4'',5,6,7,10,11,12,13,14,15,16-hexadecahydro-5''H-dispiro[cyclopenta[a]phenanthrene-17,2'-furan-5',2''-furan]-3,5''(2H)-dione
![(3'R,3''S,4S,4''R,5R,5'S,10S,13S,14S,17S)-3''-hydroxy-4-(hydroxymethyl)-3',4,4'',10,13,14-hexamethyl-1,3',3'',4,4',4'',5,6,7,10,11,12,13,14,15,16-hexadecahydro-5''H-dispiro[cyclopenta[a]phenanthrene-17,2'-furan-5',2''-furan]-3,5''(2H)-dione structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3'R,3''S,4S,4''R,5R,5'S,10S,13S,14S,17S)-3''-hydroxy-4-(hydroxymethyl)-3',4,4'',10,13,14-hexamethyl-1,3',3'',4,4',4'',5,6,7,10,11,12,13,14,15,16-hexadecahydro-5''H-dispiro[cyclopenta[a]phenanthrene-17,2'-furan-5',2''-furan]-3,5''(2H)-dione |
|---|---|
| IUPAC Name | (3'R,3''S,4S,4''R,5R,5'S,10S,13S,14S,17S)-3''-hydroxy-4-(hydroxymethyl)-3',4,4'',10,13,14-hexamethyl-1,3',3'',4,4',4'',5,6,7,10,11,12,13,14,15,16-hexadecahydro-5''H-dispiro[cyclopenta[a]phenanthrene-17,2'-furan-5',2''-furan]-3,5''(2H)-dione |
| Molecular Formula | C30H44O6 |
| Molecular Weight | 500.68 |
| SMILES | C[C@@H]1C[C@@]2(OC(=O)[C@H](C)[C@@H]2O)O[C@@]12CC[C@@]1(C)C3=C(CC[C@@]12C)[C@@]1(C)CCC(=O)[C@](C)(CO)[C@@H]1CC3 |
| InChI Key | YRNYMVDUKNBNHT-LOBUHZSXSA-N |
| Synonym | Scillascillone;Lanost-8-en-26-oic acid, 17,23-epoxy-23,24,28-trihydroxy-3-oxo-, γ-lactone, (4β,23S,24S,25R)- |
| CAS No. | 2023822-40-2 |
Synthetic Route by SureRoute
2. ACSYPI614 Molecular Building Block Synthetic Route
(2S,3R,4S,5S)-3-(((2S,3R,4S,5R,6S)-3,4-Dihydroxy-6-methyl-5-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxytetrahydro-2H-pyran-2-yl (2S,5S,5aR,7aR,7bS,9R,9aR,13aS,15aR,15bR,16R)-9-hydroxy-5-(hydroxymethyl)-7a,7b,12,12,15b-pentamethyl-4-oxo-16-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,2,5,5a,6,7,7a,7b,8,9,10,11,12,13,13a,15,15a,15b-octadecahydro-2,5-methanochryseno[1,2-d]oxepine-9a(4H)-carboxylate
3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 1,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate
(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl (4aR,5R,6aS,6bR,8aR,10S,12aR,12bR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate