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- 83991-64-4
83991-64-4
（name: 4H,6H,11H-Pyrano[4'',3'':5',6']naphtho[1',2':3,4]furo[3,2-c]pyran-4,11-dione,9-(3-furanyl)-1,2a,3,6b,7,8,8a,9,12b,13,14,14a-dodecahydro-13-hydroxy-1,1,8a,12b-tetramethyl-,(2aS,6aR,6bS,8aR,9R,12bR,13R,14aR)-）
Product name：4H,6H,11H-Pyrano[4'',3'':5',6']naphtho[1',2':3,4]furo[3,2-c]pyran-4,11-dione,9-(3-furanyl)-1,2a,3,6b,7,8,8a,9,12b,13,14,14a-dodecahydro-13-hydroxy-1,1,8a,12b-tetramethyl-,(2aS,6aR,6bS,8aR,9R,12bR,13R,14aR)-
CAS No：83991-64-4
MF：C26H32O7
MW：456.528088569641
CID：722049
PubChem ID：196266
Related Compounds
- FRAXINELLONE | 28808-62-0
- Spiro[furan-3(2H),6'-[6H]naphtho[1,8-bc]furan]-2,2'(4'H)-dione,5-(3-furanyl)-4,5,5',5'a,7',8',8'a,8'b-octahydro-8'b-(hydroxymethyl)-7'-methylene-,(3S,5S,5'aS,8'aR,8'bR)- (9CI) | 69749-00-4
- methyl (8a'S)-5-(furan-3-yl)-2',4a'-dimethyl-2-oxo-3',4,4',4a',5,7',8',8a'-octahydro-2'H-spiro[furan-3,1'-naphthalene]-5'-carboxylate | 79405-82-6
- 7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid,4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-4a,7,9,9-tetramethyl-2,10,13-trioxo-,methyl ester, (4R,4aR,7S,8S,11S)- | 3463-88-5
- Spiro[furan-3(2H),6'-[6H]naphtho[1,8-bc]furan]-2,2'(4'H)-dione,5-(3-furanyl)-4,5,5',5'a,7',8',8'a,8'b-octahydro-8'b-(hydroxymethyl)-7'-methyl-,(3R,5R,5'aS,7'R,8'aR,8'bR)- (9CI) | 124817-37-4
- 4H,6H,11H-Pyrano[4'',3'':5',6']naphtho[1',2':3,4]furo[3,2-c]pyran-4,11-dione,9-(3-furanyl)-1,2a,3,6b,7,8,8a,9,12b,13,14,14a-dodecahydro-13-hydroxy-1,1,8a,12b-tetramethyl-,(2aS,6aR,6bS,8aR,9R,12bR,13R,14aR)-
- 4H,6H,11H-Pyrano[4'',3'':5',6']naphtho[1',2':3,4]furo[3,2-c]pyran-4,11-dione,9-(3-furanyl)-1,2a,3,6b,7,8,8a,9,12b,13,14,14a-d
- 4H,6H,11H-Pyrano[4'',3'':5',6']naphtho[1',2':3,4]furo[3,2-c]pyran-4,11-dione,9-(3-furanyl)-1,2a,3,6b,7,8,8a,9,12b,13,14,14a-dodecahydro-13-hydroxy-1,1,8a,12b-tetramethyl-,(2aS,6aR,6bS,8aR,9R,12bR,13R,
- deoxylimonol
- 83991-64-4
- (1S,7S,10R,12R,13R,18R,19R)-18-(furan-3-yl)-12-hydroxy-9,9,13,19-tetramethyl-4,8,17-trioxapentacyclo[11.8.0.02,7.02,10.014,19]henicos-14-ene-5,16-dione
- Deoxylimonol
- Limonol, deoxy-
- DTXSID101004252
- Deoxy-alpha-limonol
- 1-(Furan-3-yl)-5-hydroxy-4b,7,7,14a-tetramethyl-1,4b,5,6,6a,7,8a,9,12b,13,14,14a-dodecahydro-3H,10H,12H-pyrano[4'',3'':2',3']furo[3',4':5,6]naphtho[2,1-c]pyran-3,10-dione
- Limonoic acid, 14,15-deepoxy-14,15-didehydro-7-deoxo-7-hydroxy-, 3,19:16,17-dilactone, (7alpha)-
- InChIKey：VNNZUOXOSGRYOD-DRHORCJJSA-N
- Inchi：InChI=1S/C26H32O7/c1-23(2)16-9-18(27)25(4)15(26(16)13-31-20(28)11-19(26)33-23)5-7-24(3)17(25)10-21(29)32-22(24)14-6-8-30-12-14/h6,8,10,12,15-16,18-19,22,27H,5,7,9,11,13H2,1-4H3/t15-,16-,18+,19-,22-,24+,25-,26+/m0/s1
- SMILES：C[C@](C([C@@]1(C)[C@H](O)C[C@H]2C(C)(C)O[C@@H]3[C@@]24COC(C3)=O)=C5)(CC[C@H]41)[C@H](c6ccoc6)OC5=O
Computed Properties
- Exact Mass: 456.21480336g/mol
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Rotatable Bond Count: 1
- Monoisotopic Mass: 456.21480336g/mol
- Heavy Atom Count: 33
- Complexity: 926
- Isotope Atom Count: 0
- Defined Atom Stereocenter Count: 7
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Covalently-Bonded Unit Count: 1
- XLogP3: 2.5
- Topological Polar Surface Area: 95.2Ų
Experimental Properties
- Color/Form: Solid powder
- Storage Condition：Dry, dark and store at 0-4℃ for short term (days to weeks) or -20℃ for long term (Store correctly 2-3years).
- Signal Word：Warning
-
FRAXINELLONE CAS No.: 28808-62-0
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