Account Nomilin glucoside
- Catalog No. :
- ACDIUZ841
- CAS No. :
- 123564-62-5
- Molecular Formula :
- C34H46O15
- Molecular Weight :
- 694.73
IUPAC Name:(1R,3'R,5aR,7aR,9S,11aR,11bR)-1-acetoxy-9-(furan-3-yl(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-5,5,7a,9,11b-pentamethyl-3,7-dioxododecahydro-5H-spiro[naphtho[2,1-c]oxepine-8,2'-oxirane]-3'-carboxylic acid
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Product Information
| Product Name | Nomilin glucoside |
|---|---|
| IUPAC Name | (1R,3'R,5aR,7aR,9S,11aR,11bR)-1-acetoxy-9-(furan-3-yl(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-5,5,7a,9,11b-pentamethyl-3,7-dioxododecahydro-5H-spiro[naphtho[2,1-c]oxepine-8,2'-oxirane]-3'-carboxylic acid |
| Molecular Formula | C34H46O15 |
| Molecular Weight | 694.73 |
| SMILES | O=C([C@@H]1OC([C@](C)(C(C2=COC=C2)O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)CC[C@@]45[H])1[C@]4(C)C(C[C@@]([C@]5(C)[C@H](OC(C)=O)C6)([H])C(C)(C)OC6=O)=O)O |
| InChI Key | GIVMXHQLQAIYEX-OJVPXVCRSA-N |
| Synonym | Spiro[naphth[2,1-c]oxepin-8(5H),2'-oxirane]-3'-carboxylic acid, 1-(acetyloxy)-9-[(S)-3-furanyl(β-D-glucopyranosyloxy)methyl]dodecahydro-5,5,7a,9,11b-pentamethyl-3,7-dioxo-, (1R,2'R,3'R,5aR,7aR,9S,11aR,11bR)-;Nomilin 17-O-glucoside;Spiro[naphth[2,1-c]oxepin-8(5H),2'-oxirane]-3'-carboxylic acid,1-(acetyloxy)-9-[(S)-3-furanyl(β-D-glucopyranosyloxy)methyl]dodecahydro-5,5,7a,9,11b-pentamethyl-3,7-dioxo-,(1R,2'R,3'R,5aR,7aR,9S,11aR,11bR)- |
| CAS No. | 123564-62-5 |
Synthetic Route by SureRoute
2. ACDIUZ841 Molecular Building Block Synthetic Route
10-(furan-3-yl((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-6,6,8a,10-tetramethyl-3,8-dioxodecahydro-1H,3H,6H-spiro[naphtho[1',2':3,4]furo[3,2-c]pyran-9,2'-oxirane]-3'-carboxylic acid
(1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-1-(Furan-3-yl)-4b,7,7,11a,13a-pentamethyl-3,5,9-trioxohexadecahydrooxepino[4',3':3,4]benzo[1,2-f]oxireno[2,3-d]isochromen-11-yl acetate
(1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-1-(furan-3-yl)-11-hydroxy-4b,7,7,11a,13a-pentamethyldecahydrooxepino[4',3':3,4]benzo[1,2-f]oxireno[2,3-d]isochromene-3,5,9(3aH,4bH,6H)-trione