KT 6006
TL;DR: KT 6006 (CAS 118736-03-1) is a chemical compound with molecular formula C27H21N3O7 and molecular weight 499.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (15S,16S,18R)-10,23-dihydroxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8(13),9,11,20(25),21,23,26-nonaene-16-carboperoxoate
Also Known As: KT 6006, 9,12-Epoxy-1H-diindolo(1,2,3-fg:3',2',1'-kl)pyrrolo(3,4-i)(1,6)benzodiazocine-10-carboxylic acid, 2,3,9,10,11,12-hexahydro-5,10,16-trihydroxy-9-methyl-1-oxo-, methyl ester, (9S-(9alpha,10alpha,12alpha))-, Methyl (15S,16S,18R)-10,23-dihydroxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8(13),9,11,20(25),21,23,26-nonaene-16-carboperoxoate, Methyl (5R,7S,8S)-2,11,15-trihydroxy-8-methyl-5,6,7,8-tetrahydro-13H-5,8-epoxy-4b,8a,14-triazadibenzo[b,h]cycloocta[1,2,3,4-jkl]cyclopenta[e]-as-indacene-7-carboperoxoate, Methyl 2,11,15-trihydroxy-8-methyl-5,6,7,8-tetrahydro-13H-5,8-epoxy-4b,8a,14-triazadibenzo[b,h]cycloocta[1,2,3,4-jkl]cyclopenta[e]-as-indacene-7-carboperoxoate
| Molecular Formula | C27H21N3O7 |
|---|---|
| Molecular Weight | 499.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 499.13794 |
| Heavy Atoms | 37 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 118736-03-1 |
|---|---|
| SMILES | C[C@@]12[C@H](C[C@@H](O1)N3C4=C(C=C(C=C4)O)C5=C6C(=C7C8=C(N2C7=C53)C=CC(=C8)O)CNC6=O)C(=O)OOC |
| InChIKey | JKEBWJSRGQOXNU-TUZCJGOLSA-N |
Product Overview
KT 6006 (CAS 118736-03-1), with molecular formula C27H21N3O7 and molecular weight 499.14 g/mol. IUPAC: methyl (15S,16S,18R)-10,23-dihydroxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8(13),9,11,20(25),21,23,26-nonaene-16-carboperoxoate.
Chemical Property Profile of KT 6006
Property Insights of KT 6006
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KT 6006. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KT 6006. Following Lipinski's Rule of Five, KT 6006 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KT 6006?
The CAS number of KT 6006 is 118736-03-1.
What is the molecular formula of KT 6006?
The molecular formula of KT 6006 is C27H21N3O7.
What is the molecular weight of KT 6006?
The molecular weight of KT 6006 is 499.14 g/mol.
Where can I buy KT 6006?
You can request a quote for KT 6006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KT 6006?
Yes, KEHONG BIO provides custom synthesis services for KT 6006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.