熊果烷
TL;DR: 熊果烷 (CAS 464-93-7) is a chemical compound with molecular formula C30H52 and molecular weight 412.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
熊果烷
(1S,2R,4aR,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-1,2,4a,6a,6b,9,9,12a-octamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydro-1H-picene
Also Known As: ursane, 5alpha-Ursane, (1S,2R,4aR,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-1,2,4a,6a,6b,9,9,12a-octamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydro-1H-picene, (1S,2R,4AR,6AR,6BR,8AS,12AS,12BR,14AR,14BS)-1,2,4A,6A,6B,9,9,12A-OCTAMETHYL-DOCOSAHYDROPICENE, RefChem:193331
| Molecular Formula | C30H52 |
|---|---|
| Molecular Weight | 412.41 g/mol |
| LogP | 9.1339 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 412.4069 |
| Heavy Atoms | 30 |
| Complexity | 690.15186 |
Chemical Identifiers
| CAS Number | 464-93-7 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2(CC[C@@]3([C@@H]([C@@H]2[C@H]1C)CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCCC5(C)C)C)C)C)C |
Product Overview
熊果烷 (CAS 464-93-7), with molecular formula C30H52 and molecular weight 412.41 g/mol. IUPAC: (1S,2R,4aR,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-1,2,4a,6a,6b,9,9,12a-octamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydro-1H-picene.
Chemical Property Profile of 熊果烷
Property Insights of 熊果烷
The XLogP value of 9.1339 indicates that 熊果烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 熊果烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 熊果烷 has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 熊果烷?
The CAS number of 熊果烷 is 464-93-7.
What is the molecular formula of 熊果烷?
The molecular formula of 熊果烷 is C30H52.
What is the molecular weight of 熊果烷?
The molecular weight of 熊果烷 is 412.41 g/mol.
Where can I buy 熊果烷?
You can request a quote for 熊果烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 熊果烷?
Yes, KEHONG BIO provides custom synthesis services for 熊果烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.