Cas no 27785-98-4 (19-Acetoxy-1β,3β,5-[ethylidynetris(oxy)]-14-hydroxy-5β,14β-bufa-20,22-dienolide)
![19-Acetoxy-1β,3β,5-[ethylidynetris(oxy)]-14-hydroxy-5β,14β-bufa-20,22-dienolide structure](https://ossimg.kuujia.com/scimg/28000/27785-98-4x500.png)
27785-98-4 structure
Product Name:19-Acetoxy-1β,3β,5-[ethylidynetris(oxy)]-14-hydroxy-5β,14β-bufa-20,22-dienolide
CAS No:27785-98-4
MF:C28H36O8
MW:500.580649375916
CID:286200
Update Time:2024-02-29
19-Acetoxy-1β,3β,5-[ethylidynetris(oxy)]-14-hydroxy-5β,14β-bufa-20,22-dienolide Chemical and Physical Properties
Names and Identifiers
-
- Bufa-20,22-dienolide,19-(acetyloxy)-1,3,5-[ethylidynetris(oxy)]-14-hydroxy-, (1b,3b,5b)- (9CI)
- 19-Acetoxy-1β,3β,5-[ethylidynetris(oxy)]-14-hydroxy-5β,14β-bufa-20,22-dienolide
- 5b-Bufa-20,22-dienolide, 1b,3b,5,14,19-pentahydroxy-, cyclic 1,3,5-orthoacetate19-acetate (8CI)
- BufadienolideB
- Melianthusigenin
- Orthoacetic acid, cyclic 1,3,5-ester with 1b,3b,5,14,19-pentahydroxy-5b-bufa-20,22-dienolide 19-acetate (8CI)
- CID 101306864
- Bufa-20,22-dienolide, 19-(acetyloxy)-1,3,5-[ethylidynetris(oxy)]-14-hydroxy-, (1β,3β,5β)- (9CI)
-
- Inchi： 1S/C28H36O8/c1-16(29)33-15-27-20-6-9-24(2)19(17-4-5-23(30)32-14-17)8-11-28(24,31)21(20)7-10-26(27)13-18-12-22(27)35-25(3,34-18)36-26/h4-5,14,18-22,31H,6-13,15H2,1-3H3/t18-,19+,20-,21+,22+,24+,25?,26-,27-,28-/m0/s1
- InChI Key： RRDZJCCZVWCHID-WAJAMXMFSA-N
- SMILES： O1C2(C)O[C@H]3C[C@H]([C@@]4(COC(C)=O)[C@@]1(C3)CC[C@H]1[C@]3(CC[C@H](C5=COC(C=C5)=O)[C@@]3(C)CC[C@H]41)O)O2
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 36
- Rotatable Bond Count: 4
- Complexity: 1080
- Topological Polar Surface Area: 101
Experimental Properties
- Density: 1.36±0.1 g/cm3(Predicted)
- Boiling Point: 622.4±55.0 °C(Predicted)
- pka: 14.80±0.70(Predicted)
19-Acetoxy-1β,3β,5-[ethylidynetris(oxy)]-14-hydroxy-5β,14β-bufa-20,22-dienolide Related Literature
-
J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Steroid lactones Bufanolides and derivatives
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Bufanolides and derivatives
27785-98-4 (19-Acetoxy-1β,3β,5-[ethylidynetris(oxy)]-14-hydroxy-5β,14β-bufa-20,22-dienolide) Related Products
- 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)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 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
Yunnanjiuzhen
Gold Member
Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
