Lankacidin C 8-butyrate
TL;DR: Lankacidin C 8-butyrate (CAS 51733-36-9) is a chemical compound with molecular formula C29H39NO8 and molecular weight 529.27 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)-13-hydroxy-1,4,10,19-tetramethyl-17,18-dioxo-2-(2-oxopropanoylamino)-16-oxabicyclo[13.2.2]nonadeca-3,5,9,11-tetraen-7-yl] butanoate
Also Known As: Lankacidin C 8-butyrate, 5-18-12-00135 (Beilstein Handbook Reference), [(1R,3S,4Z,6Z,9S,10Z,12Z,14R,15S)-3-hydroxy-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl] butanoate, Butanoic acid, 2-((1,2-dioxopropyl)amino)-13-hydroxy-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo(13.2.2)nonadeca-3,5,9,11-tetraen-7-yl ester, (1S- (1S-(1R*,2S*,3E,5E,7R*,9E,11E,13R*,15S*,19S*))-, Butanoic acid, 2-((1,2-dioxopropyl)amino)-13-hydroxy-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo(13.2.2)nonadeca-3,5,9,11-tetraen-7-yl ester, (1S-(1S-(1R*,2S*,3E,5E,7R*,9E,11E,13R*,15S*,19S*))-
| Molecular Formula | C29H39NO8 |
|---|---|
| Molecular Weight | 529.27 g/mol |
| LogP | 3.0687 |
| Topological Polar Surface Area | 136.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 529.2676 |
| Heavy Atoms | 38 |
| Complexity | 1068.4491 |
Chemical Identifiers
| CAS Number | 51733-36-9 |
|---|---|
| SMILES | CCCC(=O)O[C@H]\1C/C=C(\C=C/[C@H](C[C@@H]2C(C(=O)[C@]([C@@H](/C=C(\C=C1)/C)NC(=O)C(=O)C)(C(=O)O2)C)C)O)/C |
Product Overview
Lankacidin C 8-butyrate (CAS 51733-36-9), with molecular formula C29H39NO8 and molecular weight 529.27 g/mol. IUPAC: [(1S,2R,3Z,5Z,7S,9Z,11Z,13S,15R)-13-hydroxy-1,4,10,19-tetramethyl-17,18-dioxo-2-(2-oxopropanoylamino)-16-oxabicyclo[13.2.2]nonadeca-3,5,9,11-tetraen-7-yl] butanoate.
Chemical Property Profile of Lankacidin C 8-butyrate
Property Insights of Lankacidin C 8-butyrate
The XLogP value of 3.0687 indicates that Lankacidin C 8-butyrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Lankacidin C 8-butyrate. Following Lipinski's Rule of Five, Lankacidin C 8-butyrate 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 Lankacidin C 8-butyrate?
The CAS number of Lankacidin C 8-butyrate is 51733-36-9.
What is the molecular formula of Lankacidin C 8-butyrate?
The molecular formula of Lankacidin C 8-butyrate is C29H39NO8.
What is the molecular weight of Lankacidin C 8-butyrate?
The molecular weight of Lankacidin C 8-butyrate is 529.27 g/mol.
Where can I buy Lankacidin C 8-butyrate?
You can request a quote for Lankacidin C 8-butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lankacidin C 8-butyrate?
Yes, KEHONG BIO provides custom synthesis services for Lankacidin C 8-butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.