C35H52O8
TL;DR: C35H52O8 (CAS 52163-39-0) is a chemical compound with molecular formula C35H52O8 and molecular weight 600.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2S,6R,10S,11R,12S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,15-trimethyl-13-[(Z)-2-methylbut-2-enoyl]oxy-5-oxo-12-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl]methyl decanoate
Also Known As: Decanoic acid, (1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,6,8-trimethyl-9a-((2-methyl-1-oxo-2-butenyl)oxy)-5-oxo-1H-cyclopropa(3,4)benz(1,2-e)azulen-1-yl)methyl ester, (1S-(1alpha,1aalpha,1bbeta,4abeta,7aalpha,7balpha,8alpha,9aalpha(Z))), Piperidinium, 1-(carboxymethyl)-1-(3-(p-methylbenzyl)-2-butenyl)-, chloride, ethyl ester
| Molecular Formula | C35H52O8 |
|---|---|
| Molecular Weight | 600.37 g/mol |
| LogP | 5.1404 |
| Topological Polar Surface Area | 130.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 600.3662 |
| Heavy Atoms | 43 |
| Complexity | 1200.1399 |
Chemical Identifiers
| CAS Number | 52163-39-0 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OC[C@@]1([C@@H]2C1(C[C@H]([C@]3([C@H]2C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C)OC(=O)/C(=C\C)/C)C |
Product Overview
C35H52O8 (CAS 52163-39-0), with molecular formula C35H52O8 and molecular weight 600.37 g/mol. IUPAC: [(1R,2S,6R,10S,11R,12S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,15-trimethyl-13-[(Z)-2-methylbut-2-enoyl]oxy-5-oxo-12-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl]methyl decanoate.
Chemical Property Profile of C35H52O8
Property Insights of C35H52O8
The XLogP value of 5.1404 indicates that C35H52O8 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.36 Ų falls within the moderate polarity range, balancing permeability and solubility for C35H52O8. Following Lipinski's Rule of Five, C35H52O8 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C35H52O8?
The CAS number of C35H52O8 is 52163-39-0.
What is the molecular formula of C35H52O8?
The molecular formula of C35H52O8 is C35H52O8.
What is the molecular weight of C35H52O8?
The molecular weight of C35H52O8 is 600.37 g/mol.
Where can I buy C35H52O8?
You can request a quote for C35H52O8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C35H52O8?
Yes, KEHONG BIO provides custom synthesis services for C35H52O8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.