Lankacidin C diacetate
TL;DR: Lankacidin C diacetate (CAS 23498-38-6) is a chemical compound with molecular formula C29H37NO9 and molecular weight 543.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,3Z,5Z,7S,9Z,11Z,13S,15R,19R)-13-acetyloxy-1,4,10,19-tetramethyl-17,18-dioxo-2-(2-oxopropanoylamino)-16-oxabicyclo[13.2.2]nonadeca-3,5,9,11-tetraen-7-yl] acetate
Also Known As: Lankacidin C diacetate, Lankacidin C 8,14-diacetate, Propanamide, N-(7,13-bis(acetyloxy)-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo(13.2.2)nonadeca-3,5,9,11-tetraen-2-yl)-, diacetate (ester) (all-E-(1S,2R,7S,13S,15R,19R)-, Propanamide, N-(7,13-bis(acetyloxy)-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo(13.2.2)nonadeca-3,5,9,11-tetraen-2-yl)-2-oxo-, (1S-(1R*,2S*,3E,5E,7R*,9E,11E,13R*,15S*,19S*))-, [(1R,3S,4Z,6Z,9S,10Z,12Z,14R,15S,18R)-3-acetyloxy-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl] acetate
| Molecular Formula | C29H37NO9 |
|---|---|
| Molecular Weight | 543.25 g/mol |
| LogP | 2.8593 |
| Topological Polar Surface Area | 142.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 543.2468 |
| Heavy Atoms | 39 |
| Complexity | 1145.4005 |
Chemical Identifiers
| CAS Number | 23498-38-6 |
|---|---|
| SMILES | C[C@@H]1[C@H]2C[C@@H](/C=C\C(=C/C[C@@H](/C=C\C(=C/[C@H]([C@@](C1=O)(C(=O)O2)C)NC(=O)C(=O)C)\C)OC(=O)C)\C)OC(=O)C |
Product Overview
Lankacidin C diacetate (CAS 23498-38-6), with molecular formula C29H37NO9 and molecular weight 543.25 g/mol. IUPAC: [(1S,2R,3Z,5Z,7S,9Z,11Z,13S,15R,19R)-13-acetyloxy-1,4,10,19-tetramethyl-17,18-dioxo-2-(2-oxopropanoylamino)-16-oxabicyclo[13.2.2]nonadeca-3,5,9,11-tetraen-7-yl] acetate.
Chemical Property Profile of Lankacidin C diacetate
Property Insights of Lankacidin C diacetate
The XLogP value of 2.8593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lankacidin C diacetate. The TPSA of 142.14 Ų indicates high polarity, suggesting Lankacidin C diacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lankacidin C diacetate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Lankacidin C diacetate?
The CAS number of Lankacidin C diacetate is 23498-38-6.
What is the molecular formula of Lankacidin C diacetate?
The molecular formula of Lankacidin C diacetate is C29H37NO9.
What is the molecular weight of Lankacidin C diacetate?
The molecular weight of Lankacidin C diacetate is 543.25 g/mol.
Where can I buy Lankacidin C diacetate?
You can request a quote for Lankacidin C diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lankacidin C diacetate?
Yes, KEHONG BIO provides custom synthesis services for Lankacidin C diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.