Dracorubin
TL;DR: Dracorubin (CAS 66975-00-6) is a chemical compound with molecular formula C32H24O5 and molecular weight 488.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S)-9-methoxy-14-methyl-5,19-diphenyl-4,12,18-trioxapentacyclo[11.7.1.02,11.03,8.017,21]henicosa-1(21),2,8,10,13,16,19-heptaen-15-one
Also Known As: Dracorubin, methoxy-methyl-diphenyl-[?]one, KST-1A7364, KST-1A7365, C.I. 75200
| Molecular Formula | C32H24O5 |
|---|---|
| Molecular Weight | 488.16 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 488.16238 |
| Heavy Atoms | 37 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 66975-00-6 |
|---|---|
| SMILES | CC1=C2C3=C(C=C(OC3=CC1=O)C4=CC=CC=C4)C5=C6C(=C(C=C5O2)OC)CC[C@H](O6)C7=CC=CC=C7 |
| InChIKey | FWKBXSPDFCAHFN-DEOSSOPVSA-N |
Product Overview
Dracorubin (CAS 66975-00-6), with molecular formula C32H24O5 and molecular weight 488.16 g/mol. IUPAC: (5S)-9-methoxy-14-methyl-5,19-diphenyl-4,12,18-trioxapentacyclo[11.7.1.02,11.03,8.017,21]henicosa-1(21),2,8,10,13,16,19-heptaen-15-one.
Chemical Property Profile of Dracorubin
Property Insights of Dracorubin
The XLogP value of 5.3 indicates that Dracorubin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, Dracorubin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dracorubin 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 Dracorubin?
The CAS number of Dracorubin is 66975-00-6.
What is the molecular formula of Dracorubin?
The molecular formula of Dracorubin is C32H24O5.
What is the molecular weight of Dracorubin?
The molecular weight of Dracorubin is 488.16 g/mol.
Where can I buy Dracorubin?
You can request a quote for Dracorubin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dracorubin?
Yes, KEHONG BIO provides custom synthesis services for Dracorubin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.