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Home Other Building Blocks Pinoresinol Diglucoside

Pinoresinol Diglucoside

CAS No.:
63902-38-5
Catalog Number:
AG003911
Molecular Formula:
C32H42O16
Molecular Weight:
682.6663
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$133
- +
10mg
98%
1 week
United States
$194
- +
50mg
98%
1 week
United States
$557
- +
100mg
98%
1 week
United States
$960
- +
Product Description
Catalog Number:
AG003911
Chemical Name:
Pinoresinol Diglucoside
CAS Number:
63902-38-5
Molecular Formula:
C32H42O16
Molecular Weight:
682.6663
MDL Number:
MFCD06656077
IUPAC Name:
(2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-6-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C32H42O16/c1-41-19-7-13(3-5-17(19)45-31-27(39)25(37)23(35)21(9-33)47-31)29-15-11-44-30(16(15)12-43-29)14-4-6-18(20(8-14)42-2)46-32-28(40)26(38)24(36)22(10-34)48-32/h3-8,15-16,21-40H,9-12H2,1-2H3/t15-,16-,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32+/m0/s1
InChI Key:
ZJSJQWDXAYNLNS-FUPWJLLWSA-N
SMILES:
OC[C@H]1O[C@@H](Oc2ccc(cc2OC)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2ccc(c(c2)OC)O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O
Properties
Complexity:
947  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
14  
Defined Bond Stereocenter Count:
0
Exact Mass:
682.247g/mol
Formal Charge:
0
Heavy Atom Count:
48  
Hydrogen Bond Acceptor Count:
16  
Hydrogen Bond Donor Count:
8  
Isotope Atom Count:
0
Molecular Weight:
682.672g/mol
Monoisotopic Mass:
682.247g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
236A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Literature
Title Journal
Structure identification and fermentation characteristics of pinoresinol diglucoside produced by Phomopsis sp. isolated from Eucommia ulmoides Oliv. Applied microbiology and biotechnology 20120201
Development and validation of an ultra high-performance liquid chromatographic method for the determination of a diastereomeric impurity in (+)-pinoresinol diglucoside chemical reference substance. Journal of separation science 20100701
[Research on the quality changes in pre- and post-processed pieces of Eucommia ulmoides]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 20070501
[Content comparison of pinoresinol diglucoside in original and reborn bark of Eucommia ulmoides]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 20060801
Biotransformation of pinoresinol diglucoside to mammalian lignans by human intestinal microflora, and isolation of Enterococcus faecalis strain PDG-1 responsible for the transformation of (+)-pinoresinol to (+)-lariciresinol. Chemical & pharmaceutical bulletin 20030501
Lignans isolated from valerian: identification and characterization of a new olivil derivative with partial agonistic activity at A(1) adenosine receptors. Journal of natural products 20021001
Properties