Home Other Building Blocks LUTEOLIN-7,3'-DI-O-DIGLUCURONIDE

LUTEOLIN-7,3'-DI-O-DIGLUCURONIDE

CAS No.:
53965-08-5
Catalog Number:
AG00DA3I
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DA3I
Chemical Name:
LUTEOLIN-7,3'-DI-O-DIGLUCURONIDE
CAS Number:
53965-08-5
MDL Number:
MFCD09752813
IUPAC Name:
(2S,3S,4S,5R,6S)-6-[2-[3-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxyphenyl]-5-hydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI:
InChI=1S/C27H26O18/c28-9-2-1-7(3-13(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)12-6-11(30)15-10(29)4-8(5-14(15)42-12)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21+,22-,23-,26+,27+/m0/s1
InChI Key:
OPANBGHBBMSMQC-MWBUVXCNSA-N
Properties
Complexity:
1150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
10  
Defined Bond Stereocenter Count:
0
Exact Mass:
638.112g/mol
Formal Charge:
0
Heavy Atom Count:
45  
Hydrogen Bond Acceptor Count:
18  
Hydrogen Bond Donor Count:
10  
Isotope Atom Count:
0
Molecular Weight:
638.487g/mol
Monoisotopic Mass:
638.112g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
300A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties