Glaucoside H
TL;DR: Glaucoside H (CAS 87741-80-8) is a chemical compound with molecular formula C47H72O20 and molecular weight 956.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,5R,7R,8R,13S,16S,19R,22R)-7-hydroxy-8-[(2R,4R,5S,6S)-5-[(2S,4S,5S,6R)-4-hydroxy-5-[(2S,4R,5S,6S)-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5,19-dimethyl-15,18,20-trioxapentacyclo[14.5.1.04,13.05,10.019,22]docosa-1(21),10-dien-14-one
Also Known As: Glaucoside H, (4S,5R,7R,8R,13S,16S,19R,22R)-7-hydroxy-8-[(2R,4R,5S,6S)-5-[(2S,4S,5S,6R)-4-hydroxy-5-[(2S,4R,5S,6S)-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5,19-dimethyl-15,18,20-trioxapentacyclo[14.5.1.04,13.05,10.019,22]docosa-1(21),10-dien-14-one, 6H-2,3,5-Trioxapentaleno(1',6':5,6,7)cyclonona(1,2-a)naphthalen-6-one, 10-((O-beta-D-glucopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-alpha-L-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-3-O-methyl-beta-L-ribo-hexopyranosyl)oxy)-2a,12a-dimethyl-, (2aR-(2aR*,4aS*,6aS*,10R*,11R*,12aR*,12bS*,14bR*))-, (4S,5R,7R,8R,13S,16S,19R,22R)-7-hydroxy-8-((2R,4R,5S,6S)-5-((2S,4S,5S,6R)-4-hydroxy-5-((2S,4R,5S,6S)-4-methoxy-6-methyl-5-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyoxan-2-yl)oxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl)oxy-5,19-dimethyl-15,18,20-trioxapentacyclo(14.5.1.04,13.05,10.019,22)docosa-1(21),10-dien-14-one, 6H-2,3,5-Trioxapentaleno(1',6':5,6,7)cyclonona(1,2-a)naphthalen-6-one, 10-((O-beta-D-glucopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-alpha-L-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-3-O-methyl-beta-L-ribo-hexopyranosyl)oxy)-2a-2a,12a-dimethyl-, (2aR-(2aR*,4aS*,6aS*,10R*,11R*,12aR*,12bS*,14bR*))-
| Molecular Formula | C47H72O20 |
|---|---|
| Molecular Weight | 956.46 g/mol |
| LogP | 0.8285 |
| Topological Polar Surface Area | 258.44 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 11 |
| Exact Mass | 956.4617 |
| Heavy Atoms | 67 |
| Complexity | 1787.1982 |
Chemical Identifiers
| CAS Number | 87741-80-8 |
|---|---|
| SMILES | C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2[C@@H](O[C@@H](C[C@H]2OC)O[C@@H]3CC4=CC[C@H]5[C@@H]([C@]4(C[C@H]3O)C)CCC6=CO[C@@]7([C@H]6[C@@H](CO7)OC5=O)C)C)O)O[C@H]8C[C@H]([C@H]([C@@H](O8)C)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)OC |
Product Overview
Glaucoside H (CAS 87741-80-8), with molecular formula C47H72O20 and molecular weight 956.46 g/mol. IUPAC: (4S,5R,7R,8R,13S,16S,19R,22R)-7-hydroxy-8-[(2R,4R,5S,6S)-5-[(2S,4S,5S,6R)-4-hydroxy-5-[(2S,4R,5S,6S)-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5,19-dimethyl-15,18,20-trioxapentacyclo[14.5.1.04,13.05,10.019,22]docosa-1(21),10-dien-14-one.
Chemical Property Profile of Glaucoside H
Property Insights of Glaucoside H
The XLogP value of 0.8285 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glaucoside H. The TPSA of 258.44 Ų indicates high polarity, suggesting Glaucoside H may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glaucoside H has 6 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glaucoside H?
The CAS number of Glaucoside H is 87741-80-8.
What is the molecular formula of Glaucoside H?
The molecular formula of Glaucoside H is C47H72O20.
What is the molecular weight of Glaucoside H?
The molecular weight of Glaucoside H is 956.46 g/mol.
Where can I buy Glaucoside H?
You can request a quote for Glaucoside H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glaucoside H?
Yes, KEHONG BIO provides custom synthesis services for Glaucoside H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.