Cas no 97916-07-9 ((3aS)-3aβ,4,5,5a,6,7,8,9,9aβ,9bα-Decahydro-5aβ-methyl-3,9-dimethylenenaphtho[1,2-b]furan-2(3H)-one)
![(3aS)-3aβ,4,5,5a,6,7,8,9,9aβ,9bα-Decahydro-5aβ-methyl-3,9-dimethylenenaphtho[1,2-b]furan-2(3H)-one structure](https://ossimg.kuujia.com/scimg/98000/97916-07-9x500.png)
97916-07-9 structure
Product Name:(3aS)-3aβ,4,5,5a,6,7,8,9,9aβ,9bα-Decahydro-5aβ-methyl-3,9-dimethylenenaphtho[1,2-b]furan-2(3H)-one
CAS No:97916-07-9
MF:C15H20O2
MW:232.318104743958
CID:1989929
Update Time:2024-03-01
(3aS)-3aβ,4,5,5a,6,7,8,9,9aβ,9bα-Decahydro-5aβ-methyl-3,9-dimethylenenaphtho[1,2-b]furan-2(3H)-one Chemical and Physical Properties
Names and Identifiers
-
- (3aS)-3aβ,4,5,5a,6,7,8,9,9aβ,9bα-Decahydro-5aβ-methyl-3,9-dimethylenenaphtho[1,2-b]furan-2(3H)-one
- Morifolin B
-
- Inchi： 1S/C15H20O2/c1-9-5-4-7-15(3)8-6-11-10(2)14(16)17-13(11)12(9)15/h11-13H,1-2,4-8H2,3H3/t11-,12+,13-,15-/m0/s1
- InChI Key： XUYAKPXYKQEFPD-XFMPKHEZSA-N
- SMILES： O1C(=O)C(=C)[C@]2([H])CC[C@@]3(C)[C@@]([H])([C@@]12[H])C(=C)CCC3
Computed Properties
- Exact Mass: 232.146
- Monoisotopic Mass: 232.146
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 409
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 26.3A^2
(3aS)-3aβ,4,5,5a,6,7,8,9,9aβ,9bα-Decahydro-5aβ-methyl-3,9-dimethylenenaphtho[1,2-b]furan-2(3H)-one Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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