Stellettin C
TL;DR: Stellettin C (CAS 184885-07-2) is a chemical compound with molecular formula C32H42O5 and molecular weight 506.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-[(3E,5E)-6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-7-yl] acetate
Also Known As: Stellettin C, Stelletin C, [(3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-[(3E,5E)-6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-7-yl] acetate, ((3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-2-oxo-3-((3E,5E)-6-(6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene)-1,4,5,5a,7,8,9,9b-octahydrocyclopenta(a)naphthalen-7-yl) acetate, ((3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-((3E,5E)-6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene)-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta(a)naphthalen-7-yl) acetate
| Molecular Formula | C32H42O5 |
|---|---|
| Molecular Weight | 506.30 g/mol |
| LogP | 6.98752 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 506.30322 |
| Heavy Atoms | 37 |
| Complexity | 1257.9658 |
Chemical Identifiers
| CAS Number | 184885-07-2 |
|---|---|
| SMILES | CC1=CC=C(OC1=O)/C(=C/C=C/C(=C\2/C(=O)C[C@@H]3[C@@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)OC(=O)C)C)C)/C)/C |
Product Overview
Stellettin C (CAS 184885-07-2), with molecular formula C32H42O5 and molecular weight 506.30 g/mol. IUPAC: [(3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-[(3E,5E)-6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-7-yl] acetate.
Chemical Property Profile of Stellettin C
Property Insights of Stellettin C
The XLogP value of 6.98752 indicates that Stellettin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Stellettin C. Following Lipinski's Rule of Five, Stellettin C has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stellettin C?
The CAS number of Stellettin C is 184885-07-2.
What is the molecular formula of Stellettin C?
The molecular formula of Stellettin C is C32H42O5.
What is the molecular weight of Stellettin C?
The molecular weight of Stellettin C is 506.30 g/mol.
Where can I buy Stellettin C?
You can request a quote for Stellettin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stellettin C?
Yes, KEHONG BIO provides custom synthesis services for Stellettin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.