RefChem:1048880
TL;DR: RefChem:1048880 (CAS 146478-72-0) is a chemical compound with molecular formula C27H41NO8 and molecular weight 507.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E,2S)-5-[[(2R,5S,6S)-6-[(2E,4E)-5-[(4R,5R,7S)-4,7-dihydroxy-7-methyl-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate
Also Known As: WB 2663B, FR 901464, FR 901464; FR-901464; FR901464; WB 2663B, ((E,2S)-5-(((2R,5S,6S)-6-((2E,4E)-5-((4R,5R,7S)-4,7-dihydroxy-7-methyl-1,6-dioxaspiro(2.5)octan-5-yl)-3-methylpenta-2,4-dienyl)-2,5-dimethyloxan-3-yl)amino)-5-oxopent-3-en-2-yl) acetate, [(E,2S)-5-[[(2R,5S,6S)-6-[(2E,4E)-5-[(4R,5R,7S)-4,7-Dihydroxy-7-methyl-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate
| Molecular Formula | C27H41NO8 |
|---|---|
| Molecular Weight | 507.28 g/mol |
| LogP | 2.3124 |
| Topological Polar Surface Area | 126.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 507.2832 |
| Heavy Atoms | 36 |
| Complexity | 890.2045 |
Chemical Identifiers
| CAS Number | 146478-72-0 |
|---|---|
| SMILES | C[C@H]1CC([C@H](O[C@H]1C/C=C(\C)/C=C/[C@@H]2[C@H](C3(C[C@@](O2)(C)O)CO3)O)C)NC(=O)/C=C/[C@H](C)OC(=O)C |
Product Overview
RefChem:1048880 (CAS 146478-72-0), with molecular formula C27H41NO8 and molecular weight 507.28 g/mol. IUPAC: [(E,2S)-5-[[(2R,5S,6S)-6-[(2E,4E)-5-[(4R,5R,7S)-4,7-dihydroxy-7-methyl-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate.
Chemical Property Profile of RefChem:1048880
Property Insights of RefChem:1048880
The XLogP value of 2.3124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1048880. The TPSA of 126.85 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1048880. Following Lipinski's Rule of Five, RefChem:1048880 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1048880?
The CAS number of RefChem:1048880 is 146478-72-0.
What is the molecular formula of RefChem:1048880?
The molecular formula of RefChem:1048880 is C27H41NO8.
What is the molecular weight of RefChem:1048880?
The molecular weight of RefChem:1048880 is 507.28 g/mol.
Where can I buy RefChem:1048880?
You can request a quote for RefChem:1048880 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1048880?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1048880 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.