Cas no 76829-01-1 (Przewaquinone B)
Przewaquinone B structure
Product Name:Przewaquinone B
CAS No:76829-01-1
MF:C18H12O4
MW:292.285485267639
CID:2006706
PubChem ID:622085
Update Time:2025-04-21
Przewaquinone B Chemical and Physical Properties
Names and Identifiers
-
- Przewaquinone B
- 1-(Hydroxymethyl)-6-methylphenanthro[1,2-b]furan-10,11-dione
- CHEMBL4070130
- 1-(Hydroxymethyl)-6-methylphenanthro[1,2-b]furan-10,11-dione #
- SCHEMBL16152288
- 76829-01-1
- CETREAVXUDHZGK-UHFFFAOYSA-N
- Przewaquinone B
- AO-088/21192007
-
- Inchi： 1S/C18H12O4/c1-9-3-2-4-12-11(9)5-6-13-15(12)17(21)16(20)14-10(7-19)8-22-18(13)14/h2-6,8,19H,7H2,1H3
- InChI Key： CETREAVXUDHZGK-UHFFFAOYSA-N
- SMILES： O1C=C(CO)C2C(C(C3C4C=CC=C(C)C=4C=CC=3C1=2)=O)=O
Computed Properties
- Exact Mass: 292.07355886g/mol
- Monoisotopic Mass: 292.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 1
- Complexity: 488
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 67.5?2
Przewaquinone B Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
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Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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