Antibiotic GR135402
TL;DR: Antibiotic GR135402 (CAS 204199-15-5) is a chemical compound with molecular formula C34H48O9 and molecular weight 600.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,4R,5R,8R,9S,11S)-9-formyl-2-[[(2R,3S,4S,5R,6R)-3-hydroxy-5-methoxy-6-methyl-4-[(2Z,4E)-2-methylhexa-2,4-dienoyl]oxyoxan-2-yl]oxymethyl]-5-methyl-13-propan-2-yltetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1-carboxylic acid
Also Known As: Antibiotic GR135402, GR 135402, (1R,2S,4R,5R,8R,9S,11S)-9-formyl-2-[[(2R,3S,4S,5R,6R)-3-hydroxy-5-methoxy-6-methyl-4-[(2Z,4E)-2-methylhexa-2,4-dienoyl]oxyoxan-2-yl]oxymethyl]-5-methyl-13-propan-2-yltetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1-carboxylic acid, 1,4-Methano-s-indacene-3a(1H)-carboxylic acid, 4,4a,5,6,7,7a,8,8a-octahydro-8a-(((6-deoxy-4-O-methyl-3-O-((2Z,4E)-2-methyl-1-oxo-2,4-hexadieny-l)beta-D-altropyranosyl)oxy)methyl)-4-formyl-7-methyl-3-(1-methylethyl)-, (1R,3aR,4S,4aR,7R,7aR,8aS)-
| Molecular Formula | C34H48O9 |
|---|---|
| Molecular Weight | 600.33 g/mol |
| LogP | 4.4825 |
| Topological Polar Surface Area | 128.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 600.32983 |
| Heavy Atoms | 43 |
| Complexity | 1220.1099 |
Chemical Identifiers
| CAS Number | 204199-15-5 |
|---|---|
| SMILES | C/C=C/C=C(/C)\C(=O)O[C@H]1[C@@H]([C@@H](O[C@@H]([C@H]1OC)C)OC[C@]23C[C@@H]4[C@@H](CC[C@H]4[C@@]5([C@]2(C(=C[C@@H]3C5)C(C)C)C(=O)O)C=O)C)O |
Product Overview
Antibiotic GR135402 (CAS 204199-15-5), with molecular formula C34H48O9 and molecular weight 600.33 g/mol. IUPAC: (1R,2S,4R,5R,8R,9S,11S)-9-formyl-2-[[(2R,3S,4S,5R,6R)-3-hydroxy-5-methoxy-6-methyl-4-[(2Z,4E)-2-methylhexa-2,4-dienoyl]oxyoxan-2-yl]oxymethyl]-5-methyl-13-propan-2-yltetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1-carboxylic acid.
Chemical Property Profile of Antibiotic GR135402
Property Insights of Antibiotic GR135402
The XLogP value of 4.4825 indicates that Antibiotic GR135402 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Antibiotic GR135402. Following Lipinski's Rule of Five, Antibiotic GR135402 has 2 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 Antibiotic GR135402?
The CAS number of Antibiotic GR135402 is 204199-15-5.
What is the molecular formula of Antibiotic GR135402?
The molecular formula of Antibiotic GR135402 is C34H48O9.
What is the molecular weight of Antibiotic GR135402?
The molecular weight of Antibiotic GR135402 is 600.33 g/mol.
Where can I buy Antibiotic GR135402?
You can request a quote for Antibiotic GR135402 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antibiotic GR135402?
Yes, KEHONG BIO provides custom synthesis services for Antibiotic GR135402 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.