Hygrocin B
TL;DR: Hygrocin B (CAS 874384-70-0) is a chemical compound with molecular formula C28H29NO8 and molecular weight 507.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10E,12S,13S,16S)-9-ethyl-4,12-dihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.05,24.016,22]pentacosa-1(24),2,4,10,17,21-hexaene-6,15,19,23,25-pentone
Also Known As: hygrocin B, Hygrocins B, J2.852.514A, (10E,12S,13S,16S)-9-ethyl-4,12-dihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.05,24.016,22]pentacosa-1(24),2,4,10,17,21-hexaene-6,15,19,23,25-pentone, (10E,12S,13S,16S)-9-ethyl-4,12-dihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo(19.3.1.05,24.016,22)pentacosa-1(24),2,4,10,17,21-hexaene-6,15,19,23,25-pentone
| Molecular Formula | C28H29NO8 |
|---|---|
| Molecular Weight | 507.19 g/mol |
| LogP | 2.87752 |
| Topological Polar Surface Area | 147.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 507.18933 |
| Heavy Atoms | 37 |
| Complexity | 1333.8773 |
Chemical Identifiers
| CAS Number | 874384-70-0 |
|---|---|
| SMILES | CCC\1CCC(=O)C2=C(C(=CC3=C2C(=O)C4=C(C3=O)NC(=O)C=C[C@@]4(C(=O)O[C@H]([C@H](/C=C1)O)C)C)C)O |
Product Overview
Hygrocin B (CAS 874384-70-0), with molecular formula C28H29NO8 and molecular weight 507.19 g/mol. IUPAC: (10E,12S,13S,16S)-9-ethyl-4,12-dihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.05,24.016,22]pentacosa-1(24),2,4,10,17,21-hexaene-6,15,19,23,25-pentone.
Chemical Property Profile of Hygrocin B
Property Insights of Hygrocin B
The XLogP value of 2.87752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hygrocin B. The TPSA of 147.07 Ų indicates high polarity, suggesting Hygrocin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hygrocin B 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 Hygrocin B?
The CAS number of Hygrocin B is 874384-70-0.
What is the molecular formula of Hygrocin B?
The molecular formula of Hygrocin B is C28H29NO8.
What is the molecular weight of Hygrocin B?
The molecular weight of Hygrocin B is 507.19 g/mol.
Where can I buy Hygrocin B?
You can request a quote for Hygrocin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hygrocin B?
Yes, KEHONG BIO provides custom synthesis services for Hygrocin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.