C30H27N3O6
TL;DR: C30H27N3O6 (CAS 126643-38-7) is a chemical compound with molecular formula C30H27N3O6 and molecular weight 525.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (15S,16R,18R)-15-methyl-3-oxo-23-propoxy-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20(25),21,23,26-nonaene-16-carboperoxoate
Also Known As: KT 5926, 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-10-hydroxy-9-methyl-1-oxo-16-propoxy-, methyl ester, (9alpha,10beta,12alpha)-, 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-10-HYDROXY-9-METHYL-1-OXO-16-PROPOXY-, METHYL ESTER, (9S,10R,12R)-, 9-Hydroxy-9-methoxycarbonyl-8-methyl-14-n-propoxy-2,3,9,10-tetrahydro-8,11-epoxy-1H,8H,11H-2,7b,11a-triazadibenzo(a,g)cycloocta(cde)trinden-1-one, Methyl (5R,7R,8S)-15-hydroxy-8-methyl-2-propoxy-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 | C30H27N3O6 |
|---|---|
| Molecular Weight | 525.19 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 525.19 |
| Heavy Atoms | 39 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 126643-38-7 |
|---|---|
| SMILES | CCCOC1=CC2=C(C=C1)N3[C@H]4C[C@H]([C@](O4)(N5C6=CC=CC=C6C7=C8CNC(=O)C8=C2C3=C75)C)C(=O)OOC |
| InChIKey | SLLLSIAIIFCYHO-RLDZSICGSA-N |
Product Overview
C30H27N3O6 (CAS 126643-38-7), with molecular formula C30H27N3O6 and molecular weight 525.19 g/mol. IUPAC: methyl (15S,16R,18R)-15-methyl-3-oxo-23-propoxy-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20(25),21,23,26-nonaene-16-carboperoxoate.
Chemical Property Profile of C30H27N3O6
Property Insights of C30H27N3O6
The XLogP value of 4.5 indicates that C30H27N3O6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C30H27N3O6. Following Lipinski's Rule of Five, C30H27N3O6 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C30H27N3O6?
The CAS number of C30H27N3O6 is 126643-38-7.
What is the molecular formula of C30H27N3O6?
The molecular formula of C30H27N3O6 is C30H27N3O6.
What is the molecular weight of C30H27N3O6?
The molecular weight of C30H27N3O6 is 525.19 g/mol.
Where can I buy C30H27N3O6?
You can request a quote for C30H27N3O6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C30H27N3O6?
Yes, KEHONG BIO provides custom synthesis services for C30H27N3O6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.