Ulithiacyclamide B
TL;DR: Ulithiacyclamide B (CAS 122759-67-5) is a chemical compound with molecular formula C35H40N8O6S4 and molecular weight 796.1954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,4R,5S,8R,15S,18R,19S,22R)-8-benzyl-4,18-dimethyl-22-(2-methylpropyl)-3,17-dioxa-10,24,30,31-tetrathia-7,14,21,28,33,34,35,36-octazahexacyclo[13.13.4.12,5.19,12.116,19.123,26]hexatriaconta-2(36),9(35),11,16(34),23(33),25-hexaene-6,13,20,27-tetrone
Also Known As: Ulithiacyclamide B, Ulithiacyclamide, 8-de(2-methylpropyl)-8-(phenylmethyl)-, (1S,4R,5S,8R,15S,18R,19S,22R)-8-benzyl-4,18-dimethyl-22-(2-methylpropyl)-3,17-dioxa-10,24,30,31-tetrathia-7,14,21,28,33,34,35,36-octazahexacyclo[13.13.4.12,5.19,12.116,19.123,26]hexatriaconta-2(36),9(35),11,16(34),23(33),25-hexaene-6,13,20,27-tetrone, (1S,4R,5S,8R,15S,18R,19S,22R)-8-Benzyl-4,18-dimethyl-22-(2-methylpropyl)-3,17-dioxa-10,24,30,31-tetrathia-7,14,21,28,33,34,35,36-octaazahexacyclo[13.13.4.1~2,5~.1~9,12~.1~16,19~.1~23,26~]hexatriaconta-2(36),6,9(35),11,13,16(34),20,23(33),25,27-decaene-6,13,20,27-tetrol, (1S,4R,5S,8R,15S,18R,19S,22R)-8-benzyl-4,18-dimethyl-22-(2-methylpropyl)-3,17-dioxa-10,24,30,31-tetrathia-7,14,21,28,33,34,35,36-octazahexacyclo(13.13.4.12,5.19,12.116,19.123,26)hexatriaconta-2(36),9(35),11,16(34),23(33),25-hexaene-6,13,20,27-tetrone
Technical Specifications
| Molecular Formula | C35H40N8O6S4 |
| Molecular Weight | 796.1954 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 292.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 4 |
| Exact Mass | 796.1954 Da |
| Heavy Atoms | 53 |
| Complexity | 1450.0 |
| SMILES | C[C@@H]1[C@H]2C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@@H]4CSSC[C@H](C(=N2)O1)NC(=O)C5=CSC(=N5)[C@H](NC(=O)[C@@H]6[C@H](OC4=N6)C)CC(C)C)CC7=CC=CC=C7 |
| InChIKey | ALXRBWFBPYGRNS-CIQZLZIBSA-N |
Chemical Property Profile of Ulithiacyclamide B
Property Insights of Ulithiacyclamide B
The XLogP value of 3.8 indicates that Ulithiacyclamide B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 292.0 Ų indicates high polarity, suggesting Ulithiacyclamide B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ulithiacyclamide B has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ulithiacyclamide B?
The CAS number of Ulithiacyclamide B is 122759-67-5.
What is the molecular formula of Ulithiacyclamide B?
The molecular formula of Ulithiacyclamide B is C35H40N8O6S4.
What is the molecular weight of Ulithiacyclamide B?
The molecular weight of Ulithiacyclamide B is 796.1954 g/mol.
Where can I buy Ulithiacyclamide B?
You can request a quote for Ulithiacyclamide B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ulithiacyclamide B?
Yes, CoreyChem provides custom synthesis services for Ulithiacyclamide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.