(9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE
TL;DR: (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE (CAS 51757-16-5) is a chemical compound with molecular formula C38H47NO11 and molecular weight 693.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,19-dihydroxy-11-methoxy-3,7,12,15,15,18,20,24,32-nonamethyl-8,14,16,33-tetraoxa-26-azapentacyclo[25.3.1.14,7.113,17.05,30]tritriaconta-1(30),2,4,9,21,23,27-heptaene-6,25,29,31-tetrone
Also Known As: (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE
| Molecular Formula | C38H47NO11 |
|---|---|
| Molecular Weight | 693.31 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 1 |
| Exact Mass | 693.31494 |
| Heavy Atoms | 50 |
| Complexity | 1500.0 |
Chemical Identifiers
| CAS Number | 51757-16-5 |
|---|---|
| SMILES | CC1C=CC=C(C(=O)NC2=CC(=O)C3=C(C2=O)C(=C(C4=C3C(=O)C(O4)(OC=CC(C(C5C(C(C(C1O)C)OC(O5)(C)C)C)C)OC)C)C)O)C |
| InChIKey | SEJPVDHBDVWGKK-UHFFFAOYSA-N |
Product Overview
(9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE (CAS 51757-16-5), with molecular formula C38H47NO11 and molecular weight 693.31 g/mol. IUPAC: 2,19-dihydroxy-11-methoxy-3,7,12,15,15,18,20,24,32-nonamethyl-8,14,16,33-tetraoxa-26-azapentacyclo[25.3.1.14,7.113,17.05,30]tritriaconta-1(30),2,4,9,21,23,27-heptaene-6,25,29,31-tetrone.
Chemical Property Profile of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE
Property Insights of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE
The XLogP value of 5.1 indicates that (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE?
The CAS number of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE is 51757-16-5.
What is the molecular formula of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE?
The molecular formula of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE is C38H47NO11.
What is the molecular weight of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE?
The molecular weight of (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE is 693.31 g/mol.
Where can I buy (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE?
You can request a quote for (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE?
Yes, KEHONG BIO provides custom synthesis services for (9Z,21Z,23Z)-2,19-DIHYDROXY-11-METHOXY-3,7,12,15,15,18,20,24,32-NONAMETHYL-8,14,16,33-TETRAOXA-26-AZAPENTACYCLO[25.3.1.1~4,7~.1~13,17~.0~5,30~]TRITRIACONTA-1(30),2,4,9,21,23,27-HEPTAENE-6,25,29,31-TETRONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.