Tall sterols phytosterols
TL;DR: Tall sterols phytosterols (CAS 68955-15-7) is a chemical compound with molecular formula C87H152O3 and molecular weight 1245.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol;(3S,5S,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol;(3S,4S,5S,9R,10S,13R,14R,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]-4,10,13-trimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Tall sterols phytosterols, Stigmasta-7,24(28)-dien-3-ol, 4-methyl-, (3beta,4alpha,5alpha,24Z)-, mixed with (3beta,24R)-ergost-5-en-3-ol and (3beta,5alpha)-stigmastan-3-ol, Stigmasta-7,24(28)-dien-3-ol, 4-methyl-, (3.beta.,4.alpha.,5.alpha.,24Z)-, mixed with (3.beta.,24R)-ergost-5-en-3-ol and (3.beta.,5.alpha.)-stigmastan-3-ol, EINECS 273-254-5
| Molecular Formula | C87H152O3 |
|---|---|
| Molecular Weight | 1245.17 g/mol |
| LogP | 24.0102 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 1245.1742 |
| Heavy Atoms | 90 |
| Complexity | 1870.0 |
Chemical Identifiers
| CAS Number | 68955-15-7 |
|---|---|
| SMILES | CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C.CCC(CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H]([C@H]4C)O)C)C)C(C)C.C[C@H](CC[C@@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C |
| InChIKey | PRWFWKDKZMLMRW-BWMZIOJWSA-N |
Product Overview
Tall sterols phytosterols (CAS 68955-15-7), with molecular formula C87H152O3 and molecular weight 1245.17 g/mol. IUPAC: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol;(3S,5S,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol;(3S,4S,5S,9R,10S,13R,14R,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]-4,10,13-trimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of Tall sterols phytosterols
Property Insights of Tall sterols phytosterols
The XLogP value of 24.0102 indicates that Tall sterols phytosterols is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Tall sterols phytosterols. Following Lipinski's Rule of Five, Tall sterols phytosterols has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tall sterols phytosterols?
The CAS number of Tall sterols phytosterols is 68955-15-7.
What is the molecular formula of Tall sterols phytosterols?
The molecular formula of Tall sterols phytosterols is C87H152O3.
What is the molecular weight of Tall sterols phytosterols?
The molecular weight of Tall sterols phytosterols is 1245.17 g/mol.
Where can I buy Tall sterols phytosterols?
You can request a quote for Tall sterols phytosterols directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tall sterols phytosterols?
Yes, KEHONG BIO provides custom synthesis services for Tall sterols phytosterols and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.