Cas no 28400-14-8 (Cyclodeca[b]furan-6-carboxaldehyde,2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-,(3aR,4S,6E,10Z,11aR)-)
28400-14-8 structure
Product Name:Cyclodeca[b]furan-6-carboxaldehyde,2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-,(3aR,4S,6E,10Z,11aR)-
CAS No:28400-14-8
MF:C15H18O5
MW:278.300425052643
CID:270853
PubChem ID:5478095
Update Time:2025-04-19
Cyclodeca[b]furan-6-carboxaldehyde,2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-,(3aR,4S,6E,10Z,11aR)- Chemical and Physical Properties
Names and Identifiers
-
- (6E,10Z)-4-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carbaldehyde
- Cyclodeca[b]furan-6-carboxaldehyde,2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-,(3aR,4S,6E,10
- Cyclodeca[b]furan-6-carboxaldehyde,2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-,(3aR,4S,6E,10Z,11aR)-
- 4-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-6-carbaldehyde
- AC1NUGSE
- AC1Q69LX
- NSC380768
- urospermal A
- Urospermal B
- UROSPERMAL I
- 28400-14-8
- DTXSID10420472
- NSC-380768
- AKOS040735143
- NCGC00385803-01
- MEGxp0_001678
- Urospermal
-
- Inchi: 1S/C15H18O5/c1-9-14-12(18)5-10(7-16)3-2-4-11(8-17)6-13(14)20-15(9)19/h3,6-7,12-14,17-18H,1-2,4-5,8H2/b10-3+,11-6-
- InChI Key: CVISOHZWXIVDFN-MPUMUABYSA-N
- SMILES: O1C(C(=C)C2C(CC(C=O)=CCCC(CO)=CC12)O)=O |c:9,t:15|
Computed Properties
- Exact Mass: 278.11544
- Monoisotopic Mass: 278.11542367g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 489
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.1
- Topological Polar Surface Area: 83.8?2
Experimental Properties
- PSA: 83.83
- LogP: 0.67300
Cyclodeca[b]furan-6-carboxaldehyde,2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-,(3aR,4S,6E,10Z,11aR)- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
28400-14-8 (Cyclodeca[b]furan-6-carboxaldehyde,2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxo-,(3aR,4S,6E,10Z,11aR)-) Related Products
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