3-Methoxy-19-norcarda-1,3,5(10)-trienolide
TL;DR: 3-Methoxy-19-norcarda-1,3,5(10)-trienolide (CAS 4147-08-4) is a chemical compound with molecular formula C23H30O3 and molecular weight 354.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R)-4-[(8S,9S,13S,14R,17R)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxolan-2-one
Also Known As: 3-Methoxy-19-norcarda-1,3,5(10)-trienolide, 19-Norcarda-1,3,5(10)-trienolide, 3-methoxy-, 4-[3-Methoxyestra-1(10),2,4-trien-17-yl]oxolan-2-one, (4R)-4-[3-Methoxy-14beta-estra-1(10),2,4-trien-17beta-yl]oxolan-2-one, (4R)-4-[(8S,9S,13S,14R,17R)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxolan-2-one
| Molecular Formula | C23H30O3 |
|---|---|
| Molecular Weight | 354.22 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.21948 |
| Heavy Atoms | 26 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 4147-08-4 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@H]1CC[C@@H]2[C@H]4CC(=O)OC4)CCC5=C3C=CC(=C5)OC |
| InChIKey | UMVVDCRBHFCXCZ-ATLKDPDMSA-N |
Product Overview
3-Methoxy-19-norcarda-1,3,5(10)-trienolide (CAS 4147-08-4), with molecular formula C23H30O3 and molecular weight 354.22 g/mol. IUPAC: (4R)-4-[(8S,9S,13S,14R,17R)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxolan-2-one.
Chemical Property Profile of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide
Property Insights of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide
The XLogP value of 5.5 indicates that 3-Methoxy-19-norcarda-1,3,5(10)-trienolide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 3-Methoxy-19-norcarda-1,3,5(10)-trienolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-19-norcarda-1,3,5(10)-trienolide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide?
The CAS number of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide is 4147-08-4.
What is the molecular formula of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide?
The molecular formula of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide is C23H30O3.
What is the molecular weight of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide?
The molecular weight of 3-Methoxy-19-norcarda-1,3,5(10)-trienolide is 354.22 g/mol.
Where can I buy 3-Methoxy-19-norcarda-1,3,5(10)-trienolide?
You can request a quote for 3-Methoxy-19-norcarda-1,3,5(10)-trienolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-19-norcarda-1,3,5(10)-trienolide?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-19-norcarda-1,3,5(10)-trienolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.