Caracurine V
TL;DR: Caracurine V (CAS 630-87-5) is a chemical compound with molecular formula C38H40N4O2 and molecular weight 584.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9R,16S,18R,19R,20S,21R,29R,36S,38R,39R,40S)-10,30-dioxa-8,15,28,35-tetrazatridecacyclo[33.5.2.215,21.01,36.02,7.08,40.09,19.013,18.016,21.020,28.022,27.029,39.033,38]tetratetraconta-2,4,6,12,22,24,26,32-octaene
Also Known As: Caracurine V, (1R,9R,16S,18R,19R,20S,21R,29R,36S,38R,39R,40S)-10,30-dioxa-8,15,28,35-tetrazatridecacyclo[33.5.2.215,21.01,36.02,7.08,40.09,19.013,18.016,21.020,28.022,27.029,39.033,38]tetratetraconta-2,4,6,12,22,24,26,32-octaene, (1R,9R,16S,18R,19R,20S,21R,29R,36S,38R,39R,40S)-10,30-dioxa-8,15,28,35-tetrazatridecacyclo(33.5.2.215,21.01,36.02,7.08,40.09,19.013,18.016,21.020,28.022,27.029,39.033,38)tetratetraconta-2,4,6,12,22,24,26,32-octaene, (1S,3aR,9R,9aR,10R,11aS,12S,14aR,19aR,20R,20aS,20bS,21R,22aS)-2,3,9a,11,11a,13,14,19a,20a,20b,22,22a-Dodecahydro-10H,21H-1,23:12,27-dimethano-9,10:20,21-bis(epoxy(2)propeno)-9H,20H-dipyrrolo(2,3-d:2',3'-d')(1,5)diazocino(1,2,3-lm:5,6,7-l'm')dicarbazole
| Molecular Formula | C38H40N4O2 |
|---|---|
| Molecular Weight | 584.32 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 31.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 584.3151 |
| Heavy Atoms | 44 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 630-87-5 |
|---|---|
| SMILES | C1CN2CC3=CCO[C@@H]4[C@@H]5[C@H]3C[C@H]2[C@@]16[C@H]5N([C@H]7[C@@H]8[C@H]9C[C@H]1[C@@]2([C@H]8N4C3=CC=CC=C32)CCN1CC9=CCO7)C1=CC=CC=C61 |
| InChIKey | CIRUUTNLDXXBKU-HCKBHOMASA-N |
Product Overview
Caracurine V (CAS 630-87-5), with molecular formula C38H40N4O2 and molecular weight 584.32 g/mol. IUPAC: (1R,9R,16S,18R,19R,20S,21R,29R,36S,38R,39R,40S)-10,30-dioxa-8,15,28,35-tetrazatridecacyclo[33.5.2.215,21.01,36.02,7.08,40.09,19.013,18.016,21.020,28.022,27.029,39.033,38]tetratetraconta-2,4,6,12,22,24,26,32-octaene.
Chemical Property Profile of Caracurine V
Property Insights of Caracurine V
The XLogP value of 3.9 indicates that Caracurine V is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.4 Ų, Caracurine V exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Caracurine V has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Caracurine V?
The CAS number of Caracurine V is 630-87-5.
What is the molecular formula of Caracurine V?
The molecular formula of Caracurine V is C38H40N4O2.
What is the molecular weight of Caracurine V?
The molecular weight of Caracurine V is 584.32 g/mol.
Where can I buy Caracurine V?
You can request a quote for Caracurine V directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Caracurine V?
Yes, KEHONG BIO provides custom synthesis services for Caracurine V and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.