Cas no 79768-41-5 ((+)-sclareolide)
(+)-sclareolide structure
Product Name:(+)-sclareolide
CAS No:79768-41-5
MF:C16H26O2
MW:250.376445293427
CID:2010570
PubChem ID:22850643
Update Time:2025-04-21
(+)-sclareolide Chemical and Physical Properties
Names and Identifiers
-
- (+)-sclareolide
- (3aR)-(+)-sclareolide
- (3aR,5aS,9aS,9bR)-decahydro-3a,6,6,9a-tetramethylnaphtho[2,1-b]furan-2(1H)-one
- 13,14,15,16-tetranorlabdan-8,12-olide
- Norambreinolide
- Sclareolide
- {(3aR,5aS,9aS,9bR)-(+)-1,2,3a,4,5,5a,6,7,8,9,9a,9b-dodecahydro-3a,6,6,9a-tetramethylnaptho[2,1-b]furan-2-one}
- SCHEMBL1096342
-
- Inchi： 1S/C16H26O2/c1-14(2)7-5-8-15(3)11(14)6-9-16(4)12(15)10-13(17)18-16/h11-12H,5-10H2,1-4H3/t11-,12+,15-,16+/m1/s1
- InChI Key： IMKJGXCIJJXALX-KOZAUXTDSA-N
- SMILES： O1C(C[C@@H]2[C@]1(C)CC[C@@H]1C(C)(C)CCC[C@]12C)=O
Computed Properties
- Exact Mass: 250.193280068g/mol
- Monoisotopic Mass: 250.193280068g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 0
- Complexity: 387
- 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
- XLogP3: 4.3
- Topological Polar Surface Area: 26.3?2
(+)-sclareolide Related Literature
-
José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
2. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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