Onnamide
TL;DR: Onnamide (CAS 115204-07-4) is a chemical compound with molecular formula C39H63N5O12 and molecular weight 793.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2E,4E,6E,11R)-12-[(4aS,6R,8S,8aR)-4-[[(2S)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetyl]amino]-8-methoxy-7,7-dimethyl-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-yl]-11-hydroxydodeca-2,4,6-trienoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Onnamide, 2-[[(2E,4E,6E,11R)-12-[(4aS,6R,8S,8aR)-4-[[(2S)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetyl]amino]-8-methoxy-7,7-dimethyl-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-yl]-11-hydroxydodeca-2,4,6-trienoyl]amino]-5-(diaminomethylideneamino)pentanoic acid, L-Arginine, N-(12-(hexahydro-4-((hydroxy(tetrahydro-2-methoxy-5,6-dimethyl-4-methylene-2H-pyran-2-yl)acetyl)amino)-8-methoxy-7,7-dimethylpyrano(3,2-d)-1,3-dioxin-6-yl)-11-hydroxy-1-oxo-2,4,6-dodecatrienyl)-, (4S-(4alpha(R*(2S*,5S*,6S*)),4aalpha,6alpha(2E,4E,6E,11S*),8alpha,8aalpha))-
| Molecular Formula | C39H63N5O12 |
|---|---|
| Molecular Weight | 793.45 g/mol |
| LogP | 1.5278 |
| Topological Polar Surface Area | 255.74 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 20 |
| Exact Mass | 793.4473 |
| Heavy Atoms | 56 |
| Complexity | 1448.7711 |
Chemical Identifiers
| CAS Number | 115204-07-4 |
|---|---|
| SMILES | C[C@H]1[C@H](O[C@](CC1=C)([C@@H](C(=O)NC2[C@@H]3[C@@H]([C@H](C([C@H](O3)C[C@@H](CCC/C=C/C=C/C=C/C(=O)NC(CCCN=C(N)N)C(=O)O)O)(C)C)OC)OCO2)O)OC)C |
Product Overview
Onnamide (CAS 115204-07-4), with molecular formula C39H63N5O12 and molecular weight 793.45 g/mol. IUPAC: 2-[[(2E,4E,6E,11R)-12-[(4aS,6R,8S,8aR)-4-[[(2S)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetyl]amino]-8-methoxy-7,7-dimethyl-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-yl]-11-hydroxydodeca-2,4,6-trienoyl]amino]-5-(diaminomethylideneamino)pentanoic acid.
Chemical Property Profile of Onnamide
Property Insights of Onnamide
The XLogP value of 1.5278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Onnamide. The TPSA of 255.74 Ų indicates high polarity, suggesting Onnamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Onnamide has 7 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Onnamide?
The CAS number of Onnamide is 115204-07-4.
What is the molecular formula of Onnamide?
The molecular formula of Onnamide is C39H63N5O12.
What is the molecular weight of Onnamide?
The molecular weight of Onnamide is 793.45 g/mol.
Where can I buy Onnamide?
You can request a quote for Onnamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Onnamide?
Yes, KEHONG BIO provides custom synthesis services for Onnamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.