182507-20-6
RALOXIFENE 6,4'-BIS-BETA-D-GLUCURONIDE
Name
RALOXIFENE 6,4'-BIS-BETA-D-GLUCURONIDE
Formula
C40 H43 N O16 S
MolWeight
825.837
1Identification
【Name】
RALOXIFENE 6,4'-BIS-BETA-D-GLUCURONIDE
【CAS】
【MDL】
MFCD15145095
【English Synonyms】
【Formula】
C40 H43 N O16 S
【MolWeight】
825.837
【Inchi】
InChI=1S/C40H43NO16S/c42-27(19-4-8-21(9-5-19)53-17-16-41-14-2-1-3-15-41)26-24-18-23(55-40-33(48)29(44)31(46)35(57-40)38(51)52)12-13-25(24)58-36(26)20-6-10-22(11-7-20)54-39-32(47)28(43)30(45)34(56-39)37(49)50/h4-13,18,28-35,39-40,43-48H,1-3,14-17H2,(H,49,50)(H,51,52)/t28-,29-,30-,31-,32+,33+,34-,35-,39+,40+/m0/s1
【InChIKey】
InChIKey=PATGTLHTGJEFAD-SLTHDDBBSA-N
【SMILES】
c1cc(ccc1c2c(c3cc(ccc3s2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)C(=O)c5ccc(cc5)OCCN6CCCCC6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:8
H bond acceptor:17
XLogP3:-2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
RALOXIFENE 6,4'-BIS-BETA-D-GLUCURONIDE.cml
Quick Release
TOP Suppliers
CGeneTech, Inc.
Catalog No:81805 20MG
Country/Region:United States
Business Type:Others
http://www.cgenetech.com
CMS Chemicals Limited
Catalog No:MR09517 1MG
Catalog No:MR09517 5MG
Catalog No:MR09517 2MG
Country/Region:United Kingdom
Business Type:Trading Company
http://www.cms-chemicals.com
Tractus Company Limited
Catalog No:RT-015374 nullnull
Country/Region:Hong Kong
Business Type:Trading Company
http://www.tractuschem.com
More 182507-20-6 Suppliers>>
Catalog No:81805 20MG
Country/Region:United States
Business Type:Others
http://www.cgenetech.com
CMS Chemicals Limited
Catalog No:MR09517 1MG
Catalog No:MR09517 5MG
Catalog No:MR09517 2MG
Country/Region:United Kingdom
Business Type:Trading Company
http://www.cms-chemicals.com
Tractus Company Limited
Catalog No:RT-015374 nullnull
Country/Region:Hong Kong
Business Type:Trading Company
http://www.tractuschem.com
More 182507-20-6 Suppliers>>