脱水莫诺苷元
TL;DR: 脱水莫诺苷元 (CAS 59653-37-1) is a chemical compound with molecular formula C11H14O5 and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
脱水莫诺苷元
methyl 9-methyl-2,4,10-trioxatricyclo[5.3.1.03,8]undec-5-ene-6-carboxylate
Also Known As: Sarrancenia flava Extract, methyl 9-methyl-2,4,10-trioxatricyclo[5.3.1.03,8]undec-5-ene-6-carboxylate, Methyl 8-methyl-5,6,8,8a-tetrahydro-1H,4aH-1,6-epoxypyrano[3,4-c]pyran-4-carboxylate, METHYL 9-METHYL-2,4,10-TRIOXATRICYCLO[5.3.1.0(3),?]UNDEC-5-ENE-6-CARBOXYLATE, 2,5-Methano-4H,5H-pyrano[2,3-d]-1,3- dioxin-6-carboxylic acid,4a,8a-dihydro-4-methyl-,methyl ester,(2R,4S,4aS,5S,8aR)-
| Molecular Formula | C11H14O5 |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.08412 |
| Heavy Atoms | 16 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 59653-37-1 |
|---|---|
| SMILES | CC1C2C3CC(O1)OC2OC=C3C(=O)OC |
| InChIKey | QGBCGMGBGAHJIT-UHFFFAOYSA-N |
Product Overview
脱水莫诺苷元 (CAS 59653-37-1), with molecular formula C11H14O5 and molecular weight 226.08 g/mol. IUPAC: methyl 9-methyl-2,4,10-trioxatricyclo[5.3.1.03,8]undec-5-ene-6-carboxylate.
Chemical Property Profile of 脱水莫诺苷元
Property Insights of 脱水莫诺苷元
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 脱水莫诺苷元. With a topological polar surface area (TPSA) of 54.0 Ų, 脱水莫诺苷元 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 脱水莫诺苷元 has 0 hydrogen bond donor(s) and 5 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 脱水莫诺苷元?
The CAS number of 脱水莫诺苷元 is 59653-37-1.
What is the molecular formula of 脱水莫诺苷元?
The molecular formula of 脱水莫诺苷元 is C11H14O5.
What is the molecular weight of 脱水莫诺苷元?
The molecular weight of 脱水莫诺苷元 is 226.08 g/mol.
Where can I buy 脱水莫诺苷元?
You can request a quote for 脱水莫诺苷元 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 脱水莫诺苷元?
Yes, KEHONG BIO provides custom synthesis services for 脱水莫诺苷元 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.