Periplocoside D
TL;DR: Periplocoside D (CAS 116709-64-9) is a chemical compound with molecular formula C70H112O26 and molecular weight 1368.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[17-[1-[5'-[5-[5-[5-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4'-methoxy-6',9-dimethylspiro[4,5a,6,7,9,9a-hexahydropyrano[3,4-c][1,2,5]trioxepine-3,2'-oxane]-7-yl]oxyethyl]-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-2-methyl-2H-pyran-5-one
Also Known As: Periplocoside D, 4-Tetradecen-1-ol,(E), 1,3-Dihydro-5-methoxy-1,3-dimethyl-2H-indol-2-one, 6-[[17-[1-[5'-[5-[5-[5-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4'-methoxy-6',9-dimethylspiro[4,5a,6,7,9,9a-hexahydropyrano[3,4-c][1,2,5]trioxepine-3,2'-oxane]-7-yl]oxyethyl]-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-2-methyl-2H-pyran-5-one, 2H-Pyran-3(6H)-one, 2-(((3beta,20S)-20-((5-((O-6-deoxy-3-O-methyl-beta-D-galactopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl)oxy)tetrahydro-4-methoxy-6,9'-dimethylspiro(2H-pyran-2,3'(4'H)-(7H)pyrano(3,4-c)(1,2,5)trioxepin)-7'-yl)oxy)-17-hydroxypregn-5-en-3-yl)oxy)-4-methoxy-6-methyl-, (3'S-(3'alpha(4S*,5S*,6S*),5'abeta,7'alpha(6S*),9'alpha,9'aalpha))-
| Molecular Formula | C70H112O26 |
|---|---|
| Molecular Weight | 1368.74 g/mol |
| LogP | 6.1575 |
| Topological Polar Surface Area | 280.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 26 |
| Rotatable Bonds | 19 |
| Exact Mass | 1368.7441 |
| Heavy Atoms | 96 |
| Complexity | 2672.819 |
Chemical Identifiers
| CAS Number | 116709-64-9 |
|---|---|
| SMILES | CC1C=C(C(=O)C(O1)OC2CCC3(C4CCC5(C(C4CC=C3C2)CCC5(C(C)OC6CC7C(C(O6)C)OOC8(CC(C(C(O8)C)OC9CC(C(C(O9)C)OC1CC(C(C(O1)C)OC1CC(C(C(O1)C)OC1C(C(C(C(O1)C)O)OC)O)OC)OC)OC)OC)CO7)O)C)C)OC |
Product Overview
Periplocoside D (CAS 116709-64-9), with molecular formula C70H112O26 and molecular weight 1368.74 g/mol. IUPAC: 6-[[17-[1-[5'-[5-[5-[5-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4'-methoxy-6',9-dimethylspiro[4,5a,6,7,9,9a-hexahydropyrano[3,4-c][1,2,5]trioxepine-3,2'-oxane]-7-yl]oxyethyl]-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-2-methyl-2H-pyran-5-one.
Chemical Property Profile of Periplocoside D
Property Insights of Periplocoside D
The XLogP value of 6.1575 indicates that Periplocoside D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 280.82 Ų indicates high polarity, suggesting Periplocoside D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Periplocoside D has 3 hydrogen bond donor(s) and 26 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Periplocoside D?
The CAS number of Periplocoside D is 116709-64-9.
What is the molecular formula of Periplocoside D?
The molecular formula of Periplocoside D is C70H112O26.
What is the molecular weight of Periplocoside D?
The molecular weight of Periplocoside D is 1368.74 g/mol.
Where can I buy Periplocoside D?
You can request a quote for Periplocoside D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Periplocoside D?
Yes, KEHONG BIO provides custom synthesis services for Periplocoside D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.