Promothiocin A
TL;DR: Promothiocin A (CAS 156737-05-2) is a chemical compound with molecular formula C36H37N11O8S2 and molecular weight 815.2268 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(12S,19S,29S)-N-(3-amino-3-oxoprop-1-en-2-yl)-9,12,19,23-tetramethyl-14,21,28,31-tetraoxo-29-propan-2-yl-10,24-dioxa-17,34-dithia-6,13,20,27,30,35,36,37,38-nonazahexacyclo[30.2.1.18,11.115,18.122,25.02,7]octatriaconta-1(35),2(7),3,5,8,11(38),15,18(37),22,25(36),32-undecaene-5-carboxamide
Also Known As: Promothiocin A, Promotriocin A, Antibiotic SF-2741A, Alaninamide, L-valyl-2-(aminomethyl)-5-methyl-4-oxazolecarbonyl-2-((1S)-1-aminoethyl)-4-thiazolecarbonyl-6-(2-((1S)-1-aminoethyl)-5-methyl-4-oxazolyl)-5-(4-carboxy-2-thiazolyl)-2-pyridinecarbonyl-2,3-didehydro-, (4->1)-lactam, J1.307.919F
Technical Specifications
| Molecular Formula | C36H37N11O8S2 |
| Molecular Weight | 815.2268 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 336.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 4 |
| Exact Mass | 815.2268 Da |
| Heavy Atoms | 57 |
| Complexity | 1580.0 |
| SMILES | C[C@H]1C2=NC(=C(O2)C)C3=C(C=CC(=N3)C(=O)NC(=C)C(=O)N)C4=NC(=CS4)C(=O)N[C@H](C(=O)NCC5=NC(=C(O5)C)C(=O)N[C@H](C6=NC(=CS6)C(=O)N1)C)C(C)C |
| InChIKey | OUTWOIXDJMCBPB-YWTKSJFSSA-N |
Chemical Property Profile of Promothiocin A
Property Insights of Promothiocin A
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Promothiocin A. The TPSA of 336.0 Ų indicates high polarity, suggesting Promothiocin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Promothiocin A has 6 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Promothiocin A?
The CAS number of Promothiocin A is 156737-05-2.
What is the molecular formula of Promothiocin A?
The molecular formula of Promothiocin A is C36H37N11O8S2.
What is the molecular weight of Promothiocin A?
The molecular weight of Promothiocin A is 815.2268 g/mol.
Where can I buy Promothiocin A?
You can request a quote for Promothiocin A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Promothiocin A?
Yes, CoreyChem provides custom synthesis services for Promothiocin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.