isodomoic acid D
TL;DR: isodomoic acid D (CAS 101977-26-8) is a chemical compound with molecular formula C15H21NO6 and molecular weight 311.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S)-4-[(2Z,4Z,6R)-6-carboxyhepta-2,4-dien-2-yl]-3-(carboxymethyl)pyrrolidine-2-carboxylic acid
Also Known As: ISODOMOIC ACID D, (Z,Z)-Isodomoic acid, ISODOMOICACIDD, (2S,3S,4S)-3-(carboxymethyl)-4-[(2Z,4Z,6R)-7-hydroxy-6-methyl-7-oxohepta-2,4-dien-2-yl]pyrrolidine-2-carboxylic acid, (2S,3S,4S)-4-((2Z,4Z)-6-carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)pyrrolidine-2-carboxylic acid
| Molecular Formula | C15H21NO6 |
|---|---|
| Molecular Weight | 311.14 g/mol |
| LogP | 0.9731 |
| Topological Polar Surface Area | 123.93 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 311.1369 |
| Heavy Atoms | 22 |
| Complexity | 510.16205 |
Chemical Identifiers
| CAS Number | 101977-26-8 |
|---|---|
| SMILES | C[C@H](/C=C\C=C(\C)/[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O)C(=O)O |
Product Overview
isodomoic acid D (CAS 101977-26-8), with molecular formula C15H21NO6 and molecular weight 311.14 g/mol. IUPAC: (2S,3S,4S)-4-[(2Z,4Z,6R)-6-carboxyhepta-2,4-dien-2-yl]-3-(carboxymethyl)pyrrolidine-2-carboxylic acid.
Chemical Property Profile of isodomoic acid D
Property Insights of isodomoic acid D
The XLogP value of 0.9731 suggests moderate lipophilicity, balancing water solubility and membrane permeability for isodomoic acid D. The TPSA of 123.93 Ų falls within the moderate polarity range, balancing permeability and solubility for isodomoic acid D. Following Lipinski's Rule of Five, isodomoic acid D has 4 hydrogen bond donor(s) and 4 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 isodomoic acid D?
The CAS number of isodomoic acid D is 101977-26-8.
What is the molecular formula of isodomoic acid D?
The molecular formula of isodomoic acid D is C15H21NO6.
What is the molecular weight of isodomoic acid D?
The molecular weight of isodomoic acid D is 311.14 g/mol.
Where can I buy isodomoic acid D?
You can request a quote for isodomoic acid D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for isodomoic acid D?
Yes, KEHONG BIO provides custom synthesis services for isodomoic acid D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.