SAPELIN B
TL;DR: SAPELIN B (CAS 26790-94-3) is a chemical compound with molecular formula C30H50O4 and molecular weight 474.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4R,6S)-6-[(3R,9R,10R,13S,14S,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2,2-dimethyloxepane-3,4-diol
Also Known As: SAPELIN B, (3S,4R,6S)-6-[(3R,9R,10R,13S,14S,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2,2-dimethyloxepane-3,4-diol, (3S,4R,6S)-6-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2,2-dimethyloxepane-3,4-diol, Lanost-7-ene-3,23,24-triol, 21,25-epoxy-, (3alpha,13alpha,14beta,17alpha,20S,23R,24S)-
| Molecular Formula | C30H50O4 |
|---|---|
| Molecular Weight | 474.37 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 474.3709 |
| Heavy Atoms | 34 |
| Complexity | 847.0 |
Chemical Identifiers
| CAS Number | 26790-94-3 |
|---|---|
| SMILES | C[C@@]12CC[C@H]3C(=CCC4[C@@]3(CC[C@H](C4(C)C)O)C)[C@]1(CC[C@@H]2[C@@H]5C[C@H]([C@@H](C(OC5)(C)C)O)O)C |
| InChIKey | NIFGYDXBCZOSPH-BOTNWUJRSA-N |
Product Overview
SAPELIN B (CAS 26790-94-3), with molecular formula C30H50O4 and molecular weight 474.37 g/mol. IUPAC: (3S,4R,6S)-6-[(3R,9R,10R,13S,14S,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2,2-dimethyloxepane-3,4-diol.
Chemical Property Profile of SAPELIN B
Property Insights of SAPELIN B
The XLogP value of 5.5 indicates that SAPELIN B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for SAPELIN B. Following Lipinski's Rule of Five, SAPELIN B has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SAPELIN B?
The CAS number of SAPELIN B is 26790-94-3.
What is the molecular formula of SAPELIN B?
The molecular formula of SAPELIN B is C30H50O4.
What is the molecular weight of SAPELIN B?
The molecular weight of SAPELIN B is 474.37 g/mol.
Where can I buy SAPELIN B?
You can request a quote for SAPELIN B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SAPELIN B?
Yes, KEHONG BIO provides custom synthesis services for SAPELIN B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.