Home Other Building Blocks 2''-O-Rhamnosylicariside II

2''-O-Rhamnosylicariside II

CAS No.:
135293-13-9
Catalog Number:
AG009B3N
Molecular Formula:
C33H40O14
Molecular Weight:
660.6623
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$404
- +
10mg
98%
1 week
United States
$598
- +
Product Description
Catalog Number:
AG009B3N
Chemical Name:
2''-O-Rhamnosylicariside II
CAS Number:
135293-13-9
Molecular Formula:
C33H40O14
Molecular Weight:
660.6623
MDL Number:
MFCD04039816
IUPAC Name:
3-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one
InChI:
InChI=1S/C33H40O14/c1-13(2)6-11-18-19(34)12-20(35)21-24(38)30(28(45-29(18)21)16-7-9-17(42-5)10-8-16)46-33-31(26(40)23(37)15(4)44-33)47-32-27(41)25(39)22(36)14(3)43-32/h6-10,12,14-15,22-23,25-27,31-37,39-41H,11H2,1-5H3/t14-,15-,22-,23-,25+,26+,27+,31+,32-,33-/m0/s1
InChI Key:
TVBJKPLTBPGHDJ-ZJTKNEERSA-N
SMILES:
COc1ccc(cc1)c1oc2c(CC=C(C)C)c(O)cc(c2c(=O)c1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O)O)O
Properties
Complexity:
1150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
10  
Defined Bond Stereocenter Count:
0
Exact Mass:
660.242g/mol
Formal Charge:
0
Heavy Atom Count:
47  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
7  
Isotope Atom Count:
0
Molecular Weight:
660.669g/mol
Monoisotopic Mass:
660.242g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
214A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties