赤霉酸
TL;DR: 赤霉酸 (CAS 77-06-5) is a chemical compound with molecular formula C19H22O6 and molecular weight 346.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
赤霉酸
(1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid
Also Known As: GIBBERELLIC ACID, Gibberellin A3, Gibberellin, Berelex, Brellin
| Molecular Formula | C19H22O6 |
|---|---|
| Molecular Weight | 346.14 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.14163 |
| Heavy Atoms | 25 |
| Complexity | 772.0 |
| Melting Point | 451 to 235.0 °C (DECOMPOSES) |
| Density | Bulk density = 600 mg/ml at 28 °C |
| Solubility | Slightly soluble (NTP, 1992) |
Chemical Identifiers
| CAS Number | 77-06-5 |
|---|---|
| SMILES | C[C@@]12[C@H](C=C[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O |
| InChIKey | IXORZMNAPKEEDV-OBDJNFEBSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
赤霉酸 (CAS 77-06-5), with molecular formula C19H22O6 and molecular weight 346.14 g/mol. IUPAC: (1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid.
Chemical Property Profile of 赤霉酸
Property Insights of 赤霉酸
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 赤霉酸. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 赤霉酸. Following Lipinski's Rule of Five, 赤霉酸 has 3 hydrogen bond donor(s) and 6 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 赤霉酸?
The CAS number of 赤霉酸 is 77-06-5.
What is the molecular formula of 赤霉酸?
The molecular formula of 赤霉酸 is C19H22O6.
What is the molecular weight of 赤霉酸?
The molecular weight of 赤霉酸 is 346.14 g/mol.
Where can I buy 赤霉酸?
You can request a quote for 赤霉酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 赤霉酸?
Yes, KEHONG BIO provides custom synthesis services for 赤霉酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.