原人参二醇
TL;DR: 原人参二醇 (CAS 30636-90-9) is a chemical compound with molecular formula C30H52O3 and molecular weight 460.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
原人参二醇
(3S,8R,9S,10R,12R,13S,14R,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol
Also Known As: 20(S)-protopanaxadiol, (20S)-Protopanaxadiol?, (3beta,5xi,12beta,13alpha,14beta)-lanost-24-ene-3,12,20-triol, (1S,3aR,3bR,7S,9aR,9bS,11R,11aS)-1-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-3a,6,6,9a,11a-pentamethyl-dodecahydro-1H-cyclopenta[a]phenanthrene-7,11-diol, (3S,8R,9S,10R,12R,13S,14R,17S)-17-((S)-2-hydroxy-6-methylhept-5-en-2-yl)-4,4,10,13,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol
| Molecular Formula | C30H52O3 |
|---|---|
| Molecular Weight | 460.39 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.39163 |
| Heavy Atoms | 33 |
| Complexity | 783.0 |
Chemical Identifiers
| CAS Number | 30636-90-9 |
|---|---|
| SMILES | CC(=CCC[C@@](C)([C@H]1CC[C@]2([C@]1([C@@H](C[C@H]3[C@H]2CCC4[C@@]3(CC[C@@H](C4(C)C)O)C)O)C)C)O)C |
| InChIKey | SOFRKDBOODGBCL-LNTRKWQZSA-N |
Product Overview
原人参二醇 (CAS 30636-90-9), with molecular formula C30H52O3 and molecular weight 460.39 g/mol. IUPAC: (3S,8R,9S,10R,12R,13S,14R,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol.
Chemical Property Profile of 原人参二醇
Property Insights of 原人参二醇
The XLogP value of 7.2 indicates that 原人参二醇 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 原人参二醇. Following Lipinski's Rule of Five, 原人参二醇 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 原人参二醇?
The CAS number of 原人参二醇 is 30636-90-9.
What is the molecular formula of 原人参二醇?
The molecular formula of 原人参二醇 is C30H52O3.
What is the molecular weight of 原人参二醇?
The molecular weight of 原人参二醇 is 460.39 g/mol.
Where can I buy 原人参二醇?
You can request a quote for 原人参二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 原人参二醇?
Yes, KEHONG BIO provides custom synthesis services for 原人参二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.