16-Hydroxycleroda-3,13(14)-dien-15,16-olide
TL;DR: 16-Hydroxycleroda-3,13(14)-dien-15,16-olide (CAS 92590-61-9) is a chemical compound with molecular formula C30H42NO10 and molecular weight 576.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: 16-Hydroxycleroda-3,13(14)-dien-15,16-olide, 3-Oxazolidinyloxy, 2-(2-((9a-(acetyloxy)-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1H-cyclopropa(3,4)benz(1,2-e)azulen-9-yl)oxy)-2-oxoethyl)-2,4,4-trimethyl-, [2-(2-{[9a-(Acetyloxy)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl]oxy}-2-oxoethyl)-2,4,4-trimethyl-1,3-oxazolidin-3-yl]oxidanyl, 3-Oxazolidinyloxy, 2-[2-[[9a-(acetyloxy)-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1H-cyclopropa[3,4]benz[1,2-e]azulen-9-yl]oxy]-2-oxoethyl]-2,4,4-trimethyl-
| Molecular Formula | C30H42NO10 |
|---|---|
| Molecular Weight | 576.28 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 576.2809 |
| Heavy Atoms | 41 |
| Complexity | 1260.0 |
Chemical Identifiers
| CAS Number | 92590-61-9 |
|---|---|
| SMILES | CC1C(C2(C(C2(C)C)C3C1(C4C=C(C(=O)C4(CC(=C3)CO)O)C)O)OC(=O)C)OC(=O)CC5(N(C(CO5)(C)C)[O])C |
| InChIKey | QMVOEQXDNUHKGA-UHFFFAOYSA-N |
Product Overview
16-Hydroxycleroda-3,13(14)-dien-15,16-olide (CAS 92590-61-9), with molecular formula C30H42NO10 and molecular weight 576.28 g/mol.
Chemical Property Profile of 16-Hydroxycleroda-3,13(14)-dien-15,16-olide
Property Insights of 16-Hydroxycleroda-3,13(14)-dien-15,16-olide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 16-Hydroxycleroda-3,13(14)-dien-15,16-olide. The TPSA of 144.0 Ų indicates high polarity, suggesting 16-Hydroxycleroda-3,13(14)-dien-15,16-olide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 16-Hydroxycleroda-3,13(14)-dien-15,16-olide has 3 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 16-Hydroxycleroda-3,13(14)-dien-15,16-olide?
The CAS number of 16-Hydroxycleroda-3,13(14)-dien-15,16-olide is 92590-61-9.
What is the molecular formula of 16-Hydroxycleroda-3,13(14)-dien-15,16-olide?
The molecular formula of 16-Hydroxycleroda-3,13(14)-dien-15,16-olide is C30H42NO10.
What is the molecular weight of 16-Hydroxycleroda-3,13(14)-dien-15,16-olide?
The molecular weight of 16-Hydroxycleroda-3,13(14)-dien-15,16-olide is 576.28 g/mol.
Where can I buy 16-Hydroxycleroda-3,13(14)-dien-15,16-olide?
You can request a quote for 16-Hydroxycleroda-3,13(14)-dien-15,16-olide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16-Hydroxycleroda-3,13(14)-dien-15,16-olide?
Yes, KEHONG BIO provides custom synthesis services for 16-Hydroxycleroda-3,13(14)-dien-15,16-olide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.