Ohchinolid A
TL;DR: Ohchinolid A (CAS 71902-48-2) is a chemical compound with molecular formula C37H42O10 and molecular weight 646.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2R,6S,11R,12S,13R,16R,17R,19S,20R)-17,19-diacetyloxy-8-(furan-3-yl)-1,9,11,16-tetramethyl-4-oxo-5,14-dioxapentacyclo[11.6.1.02,11.06,10.016,20]icos-9-en-12-yl] benzoate
Also Known As: Ohchinolid A, 2H,5H-Cyclopent(a)isobenzofuro(7,1-gh)(3)benzoxepin-5-one,7,9-bis(acetyloxy)-12-(benzoyloxy)-2-(3-furanyl)-3,3a,6,6a,6b,7,8,9,9a,10,11a,11b,12,12a-tetradecahydro-1,6b,9a,12a-tetramethyl-, (2R,3aS,6aR,6bR,7S,9R,9aR,11aR,11bR,12S,12aR)-, (3aS,6aR,6bR,7S,9R,9aR,11aR,11bR,12S,12aR)-7,9-Bis(acetyloxy)-2-(furan-3-yl)-1,6b,9a,12a-tetramethyl-5-oxo-3,3a,6,6a,6b,7,8,9,9a,10,11a,11b,12,12a-tetradecahydro-2H,5H-cyclopenta[b]furo[2',3',4':4,5]naphtho[2,1-d]oxepin-12-yl benzoate, 7,9-Bis(acetyloxy)-2-(furan-3-yl)-1,6b,9a,12a-tetramethyl-5-oxo-3,3a,6,6a,6b,7,8,9,9a,10,11a,11b,12,12a-tetradecahydro-2H,5H-cyclopenta[b]furo[2',3',4':4,5]naphtho[2,1-d]oxepin-12-yl benzoate
| Molecular Formula | C37H42O10 |
|---|---|
| Molecular Weight | 646.28 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 646.2778 |
| Heavy Atoms | 47 |
| Complexity | 1350.0 |
Chemical Identifiers
| CAS Number | 71902-48-2 |
|---|---|
| SMILES | CC1=C2[C@H](CC1C3=COC=C3)OC(=O)C[C@H]4[C@]2([C@@H]([C@H]5[C@@H]6[C@@]4([C@H](C[C@H]([C@]6(CO5)C)OC(=O)C)OC(=O)C)C)OC(=O)C7=CC=CC=C7)C |
| InChIKey | ASXOZSKFUKLCDP-SWVFQSRTSA-N |
Product Overview
Ohchinolid A (CAS 71902-48-2), with molecular formula C37H42O10 and molecular weight 646.28 g/mol. IUPAC: [(1R,2R,6S,11R,12S,13R,16R,17R,19S,20R)-17,19-diacetyloxy-8-(furan-3-yl)-1,9,11,16-tetramethyl-4-oxo-5,14-dioxapentacyclo[11.6.1.02,11.06,10.016,20]icos-9-en-12-yl] benzoate.
Chemical Property Profile of Ohchinolid A
Property Insights of Ohchinolid A
The XLogP value of 4.4 indicates that Ohchinolid A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ohchinolid A. Following Lipinski's Rule of Five, Ohchinolid A has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ohchinolid A?
The CAS number of Ohchinolid A is 71902-48-2.
What is the molecular formula of Ohchinolid A?
The molecular formula of Ohchinolid A is C37H42O10.
What is the molecular weight of Ohchinolid A?
The molecular weight of Ohchinolid A is 646.28 g/mol.
Where can I buy Ohchinolid A?
You can request a quote for Ohchinolid A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ohchinolid A?
Yes, KEHONG BIO provides custom synthesis services for Ohchinolid A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.