C-2 Triptofordin
TL;DR: C-2 Triptofordin (CAS 111514-63-7) is a chemical compound with molecular formula C33H38O11 and molecular weight 610.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,4R,5S,6R,7S,8R,9R,12R)-5,12-diacetyloxy-7-benzoyloxy-2,4-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] benzoate
Also Known As: C-2 Triptofordin, Triptofordin C 2, triptofordin C-2, (3R-(3alpha,4beta,5beta,5aalpha,6alpha,7alpha,9beta,9aalpha,10R*))-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-4,5,6,7,9,10-hexol 6,10-diacetate 4,5-dibenzoate, 2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, octahydro-2,2,5a,9-tetramethyl-, 6,10-diacetate 4,5-dibenzoate, (3R-(3alpha,4beta,5beta,5aalpha,6alpha,7alpha,9beta,9aalpha,10R*))-
| Molecular Formula | C33H38O11 |
|---|---|
| Molecular Weight | 610.24 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 610.2414 |
| Heavy Atoms | 44 |
| Complexity | 1140.0 |
Chemical Identifiers
| CAS Number | 111514-63-7 |
|---|---|
| SMILES | CC(=O)O[C@@H]1[C@@H](C[C@@](C23[C@]1([C@@H]([C@@H]([C@H]([C@H]2OC(=O)C)C(O3)(C)C)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)C)(C)O)O |
| InChIKey | FOIOSVGAFMLLDU-QGCFOTDLSA-N |
Product Overview
C-2 Triptofordin (CAS 111514-63-7), with molecular formula C33H38O11 and molecular weight 610.24 g/mol. IUPAC: [(2R,4R,5S,6R,7S,8R,9R,12R)-5,12-diacetyloxy-7-benzoyloxy-2,4-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] benzoate.
Chemical Property Profile of C-2 Triptofordin
Property Insights of C-2 Triptofordin
The XLogP value of 3.3 indicates that C-2 Triptofordin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.0 Ų indicates high polarity, suggesting C-2 Triptofordin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C-2 Triptofordin has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C-2 Triptofordin?
The CAS number of C-2 Triptofordin is 111514-63-7.
What is the molecular formula of C-2 Triptofordin?
The molecular formula of C-2 Triptofordin is C33H38O11.
What is the molecular weight of C-2 Triptofordin?
The molecular weight of C-2 Triptofordin is 610.24 g/mol.
Where can I buy C-2 Triptofordin?
You can request a quote for C-2 Triptofordin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C-2 Triptofordin?
Yes, KEHONG BIO provides custom synthesis services for C-2 Triptofordin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.