Cimiacerol
TL;DR: Cimiacerol (CAS 73105-33-6) is a chemical compound with molecular formula C30H46O5 and molecular weight 486.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R,8S,9R,12R,13R,15S,17R,21S,23R)-6,8,11,11,17,22,22-heptamethyl-10,14,26-trioxaheptacyclo[21.2.1.01,21.03,18.06,17.07,15.09,13]hexacos-3(18)-ene-12,13-diol
Also Known As: Cimiacerol, B(9a)-Homo-19-norlanosta-8-en-15-ol-diol, 3,10:16,23:22,25-triepoxy-, (3beta,15beta,16beta)-, (2R,7aR,7bR,8S,8aR,11R,11aR,12aS,13aR,15aS)-1,1,7a,8,10,10,13a-Heptamethyl-1,3,4,5,6,7,7a,7b,8,8a,10,11,12a,13,13a,14,15,15a-octadecahydro-2,4a-epoxybenzo[4',5']cyclohepta[1',2':4,5]indeno[2,1-b]furo[2,3-e]pyran-11,11a(2H)-diol, 1,1,7a,8,10,10,13a-Heptamethyl-1,3,4,5,6,7,7a,7b,8,8a,10,11,12a,13,13a,14,15,15a-octadecahydro-2,4a-epoxybenzo[4',5']cyclohepta[1',2':4,5]indeno[2,1-b]furo[2,3-e]pyran-11,11a(2H)-diol
| Molecular Formula | C30H46O5 |
|---|---|
| Molecular Weight | 486.33 g/mol |
| LogP | 5.1288 |
| Topological Polar Surface Area | 68.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 486.33453 |
| Heavy Atoms | 35 |
| Complexity | 1000.70593 |
Chemical Identifiers
| CAS Number | 73105-33-6 |
|---|---|
| SMILES | C[C@H]1[C@H]2[C@H](C[C@@]3([C@@]2(CCC4=C3CC[C@H]5C([C@H]6CCC5(C4)O6)(C)C)C)C)O[C@]7([C@@H]1OC([C@H]7O)(C)C)O |
Product Overview
Cimiacerol (CAS 73105-33-6), with molecular formula C30H46O5 and molecular weight 486.33 g/mol. IUPAC: (6R,7R,8S,9R,12R,13R,15S,17R,21S,23R)-6,8,11,11,17,22,22-heptamethyl-10,14,26-trioxaheptacyclo[21.2.1.01,21.03,18.06,17.07,15.09,13]hexacos-3(18)-ene-12,13-diol.
Chemical Property Profile of Cimiacerol
Property Insights of Cimiacerol
The XLogP value of 5.1288 indicates that Cimiacerol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.15 Ų falls within the moderate polarity range, balancing permeability and solubility for Cimiacerol. Following Lipinski's Rule of Five, Cimiacerol has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cimiacerol?
The CAS number of Cimiacerol is 73105-33-6.
What is the molecular formula of Cimiacerol?
The molecular formula of Cimiacerol is C30H46O5.
What is the molecular weight of Cimiacerol?
The molecular weight of Cimiacerol is 486.33 g/mol.
Where can I buy Cimiacerol?
You can request a quote for Cimiacerol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cimiacerol?
Yes, KEHONG BIO provides custom synthesis services for Cimiacerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.