Cas no 175862-78-9 (Hasubanan-6-one, 7,8-didehydro-2-hydroxy-3,7,8-trimethoxy-17-methyl- (9CI))
175862-78-9 structure
Product Name:Hasubanan-6-one, 7,8-didehydro-2-hydroxy-3,7,8-trimethoxy-17-methyl- (9CI)
CAS No:175862-78-9
MF:C20H25NO5
MW:359.416206121445
CID:232262
Update Time:2024-03-01
Hasubanan-6-one, 7,8-didehydro-2-hydroxy-3,7,8-trimethoxy-17-methyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Hasubanan-6-one,7,8-didehydro-2-hydroxy-3,7,8-trimethoxy-17-methyl- (9CI)
- (-)-Cephatonine
- Cephatonine
- CID 102066922
- Hasubanan-6-one, 7,8-didehydro-2-hydroxy-3,7,8-trimethoxy-17-methyl- (9CI)
-
- Inchi： 1S/C20H25NO5/c1-21-8-7-19-11-15(23)17(25-3)18(26-4)20(19,21)6-5-12-9-14(22)16(24-2)10-13(12)19/h9-10,22H,5-8,11H2,1-4H3/t19?,20-/m1/s1
- InChI Key： HTOHHJTUVLJPIE-GFOWMXPYSA-N
- SMILES： CN1[C@]23C(OC)=C(OC)C(CC2(C2C(=CC(O)=C(OC)C=2)CC3)CC1)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 3
- Complexity: 634
- Topological Polar Surface Area: 68.2
- XLogP3: 0.332
Experimental Properties
- Density: 1.30±0.1 g/cm3(Predicted)
- Boiling Point: 577.7±50.0 °C(Predicted)
- pka: 9.71±0.60(Predicted)
Hasubanan-6-one, 7,8-didehydro-2-hydroxy-3,7,8-trimethoxy-17-methyl- (9CI) Related Literature
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
175862-78-9 (Hasubanan-6-one, 7,8-didehydro-2-hydroxy-3,7,8-trimethoxy-17-methyl- (9CI)) Related Products
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
- 2034271-14-0(2-(1H-indol-3-yl)-N-{[6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide)
Recommended suppliers
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
