Longispinogenin
TL;DR: Longispinogenin (CAS 4743-55-9) is a chemical compound with molecular formula C31H52O3 and molecular weight 472.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4aR,6aR,6bS,8S,8aR,12aS,14aR,14bR)-8,8a-bis(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-ol
Also Known As: Longispinogenin, KST-1A4961, 16-(Hydroxymethyl)olean-12-ene-3,28-diol, 16beta-(Hydroxymethyl)olean-12-ene-3beta,28-diol, (3S,4aR,5R,6aR,6bS,8S,8aR,12aS,14aR,14bR)-8,8a-Bis-hydroxymethyl-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-picen-3-ol
| Molecular Formula | C31H52O3 |
|---|---|
| Molecular Weight | 472.39 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 472.39163 |
| Heavy Atoms | 34 |
| Complexity | 859.0 |
Chemical Identifiers
| CAS Number | 4743-55-9 |
|---|---|
| SMILES | C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@@H]([C@@]5([C@H]4CC(CC5)(C)C)CO)CO)C)C)(C)C)O |
| InChIKey | NGJUAJNTJXNCFH-VUTUYJMDSA-N |
Product Overview
Longispinogenin (CAS 4743-55-9), with molecular formula C31H52O3 and molecular weight 472.39 g/mol. IUPAC: (3S,4aR,6aR,6bS,8S,8aR,12aS,14aR,14bR)-8,8a-bis(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-ol.
Chemical Property Profile of Longispinogenin
Property Insights of Longispinogenin
The XLogP value of 6.6 indicates that Longispinogenin 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 Longispinogenin. Following Lipinski's Rule of Five, Longispinogenin 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 Longispinogenin?
The CAS number of Longispinogenin is 4743-55-9.
What is the molecular formula of Longispinogenin?
The molecular formula of Longispinogenin is C31H52O3.
What is the molecular weight of Longispinogenin?
The molecular weight of Longispinogenin is 472.39 g/mol.
Where can I buy Longispinogenin?
You can request a quote for Longispinogenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Longispinogenin?
Yes, KEHONG BIO provides custom synthesis services for Longispinogenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.