Nimbione
TL;DR: Nimbione (CAS 13519-80-7) is a chemical compound with molecular formula C18H22O3 and molecular weight 286.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aS,10aR)-7-hydroxy-1,1,4a,6-tetramethyl-3,4,10,10a-tetrahydrophenanthrene-2,9-dione
Also Known As: Nimbione, 13-hydroxy-12-methylpodocarpa-8,11,13-triene-3,7-dione, (4aS,10aR)-7-hydroxy-1,1,4a,6-tetramethyl-3,4,10,10a-tetrahydrophenanthrene-2,9-dione, 13-Hydroxy-12-methylpodocarpa-8(14),9(11),12-triene-3,7-dione, 2,9(1H,3H)-Phenanthrenedione, 4,4a,10,10a-tetrahydro-7-hydroxy-1,1,4a,6-tetramethyl-, (4aS-trans)-
| Molecular Formula | C18H22O3 |
|---|---|
| Molecular Weight | 286.16 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 286.1569 |
| Heavy Atoms | 21 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 13519-80-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1O)C(=O)C[C@@H]3[C@@]2(CCC(=O)C3(C)C)C |
| InChIKey | LADNAJMEYZHPOD-MAUKXSAKSA-N |
Product Overview
Nimbione (CAS 13519-80-7), with molecular formula C18H22O3 and molecular weight 286.16 g/mol. IUPAC: (4aS,10aR)-7-hydroxy-1,1,4a,6-tetramethyl-3,4,10,10a-tetrahydrophenanthrene-2,9-dione.
Chemical Property Profile of Nimbione
Property Insights of Nimbione
The XLogP value of 3.0 indicates that Nimbione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, Nimbione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nimbione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nimbione?
The CAS number of Nimbione is 13519-80-7.
What is the molecular formula of Nimbione?
The molecular formula of Nimbione is C18H22O3.
What is the molecular weight of Nimbione?
The molecular weight of Nimbione is 286.16 g/mol.
Where can I buy Nimbione?
You can request a quote for Nimbione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nimbione?
Yes, KEHONG BIO provides custom synthesis services for Nimbione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.