3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde
TL;DR: 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde (CAS 66409-98-1) is a chemical compound with molecular formula C28H39NO4 and molecular weight 453.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3'aS,7'aR,9R)-3-hydroxy-3',6',10,11b-tetramethyl-11-oxospiro[1,2,3,4,6,6a,6b,7,8,11a-decahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-carbaldehyde
Also Known As: N-Formyljervine, JERVINE, N-FORMYL-, 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde, (3'aS,7'aR,9R)-3-hydroxy-3',6',10,11b-tetramethyl-11-oxospiro[1,2,3,4,6,6a,6b,7,8,11a-decahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-carbaldehyde, (8xi,9xi,10xi,14xi,22S,23R,25xi)-3-Hydroxy-11-oxo-20xi-17,23-epoxyveratraman-28-carbaldehyde
| Molecular Formula | C28H39NO4 |
|---|---|
| Molecular Weight | 453.29 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 453.2879 |
| Heavy Atoms | 33 |
| Complexity | 954.0 |
Chemical Identifiers
| CAS Number | 66409-98-1 |
|---|---|
| SMILES | CC1C[C@@H]2[C@H](C([C@]3(O2)CCC4C5CC=C6CC(CCC6(C5C(=O)C4=C3C)C)O)C)N(C1)C=O |
| InChIKey | WAULJAUXPVUQMT-HXQQKEKESA-N |
Product Overview
3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde (CAS 66409-98-1), with molecular formula C28H39NO4 and molecular weight 453.29 g/mol. IUPAC: (3'aS,7'aR,9R)-3-hydroxy-3',6',10,11b-tetramethyl-11-oxospiro[1,2,3,4,6,6a,6b,7,8,11a-decahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-carbaldehyde.
Chemical Property Profile of 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde
Property Insights of 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde. Following Lipinski's Rule of Five, 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde has 1 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 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde?
The CAS number of 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde is 66409-98-1.
What is the molecular formula of 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde?
The molecular formula of 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde is C28H39NO4.
What is the molecular weight of 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde?
The molecular weight of 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde is 453.29 g/mol.
Where can I buy 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde?
You can request a quote for 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-11-oxo-17,23-epoxyveratraman-28-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.