Cas no 156857-59-9 (b-D-Glucopyranoside, (3b,5b,22a,25S)-22-methoxyfurostan-3,26-diyl bis- (9CI))
156857-59-9 structure
Product Name:b-D-Glucopyranoside, (3b,5b,22a,25S)-22-methoxyfurostan-3,26-diyl bis- (9CI)
CAS No:156857-59-9
MF:C40H68O14
MW:772.959534645081
CID:160697
PubChem ID:190854
Update Time:2025-04-19
b-D-Glucopyranoside, (3b,5b,22a,25S)-22-methoxyfurostan-3,26-diyl bis- (9CI) Chemical and Physical Properties
Names and Identifiers
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- b-D-Glucopyranoside, (3b,5b,22a,25S)-22-methoxyfurostan-3,26-diyl bis- (9CI)
- (-)-Filicinoside A
- (3beta,5beta)-26-(beta-D-glucopyranosyloxy)-22-methoxyfurostan-3-yl beta-D-glucopyranoside
- 3-O-beta-D-Glucopyranosyl-26-O-beta-D-glucopyranosyl-22-alpha-methoxy-5beta-furostan-3beta,26-diol
- beta-D-Glucopyranoside, (3beta,5beta,22alpha,25S)-22-methoxyfurostan-3,26-diyl bis-
- Filicinoside A
- 26-(Hexopyranosyloxy)-22-methoxyfurostan-3-yl hexopyranoside
- 156857-59-9
- DTXSID00935545
- (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[4-[(1R,2S,4S,7S,8R,9S,12S,13S,16S,18R)-6-methoxy-7,9,13-trimethyl-16-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-6-yl]-2-methylbutoxy]oxane-3,4,5-triol
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- Inchi: 1S/C40H68O14/c1-19(18-50-36-34(47)32(45)30(43)27(16-41)52-36)8-13-40(49-5)20(2)29-26(54-40)15-25-23-7-6-21-14-22(9-11-38(21,3)24(23)10-12-39(25,29)4)51-37-35(48)33(46)31(44)28(17-42)53-37/h19-37,41-48H,6-18H2,1-5H3/t19?,20-,21+,22-,23+,24-,25-,26-,27+,28+,29-,30+,31+,32-,33-,34+,35+,36+,37+,38-,39-,40?/m0/s1
- InChI Key: JOLRNAYMVQBIMR-PLYJIFKSSA-N
- SMILES: O1C(CCC(C)CO[C@H]2[C@@H]([C@H]([C@@H]([C@@H](CO)O2)O)O)O)([C@@H](C)[C@H]2[C@@H]1C[C@H]1[C@@H]3CC[C@@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@@]12C)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)OC
Computed Properties
- Exact Mass: 772.461
- Monoisotopic Mass: 772.461
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 14
- Heavy Atom Count: 54
- Rotatable Bond Count: 11
- Complexity: 1280
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 20
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 217?2
Experimental Properties
- Density: 1.34
- Boiling Point: 869.8°Cat760mmHg
- Flash Point: 479.8°C
- Refractive Index: 1.595
b-D-Glucopyranoside, (3b,5b,22a,25S)-22-methoxyfurostan-3,26-diyl bis- (9CI) Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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