Janthitrem C
TL;DR: Janthitrem C (CAS 73561-91-8) is a chemical compound with molecular formula C37H47NO4 and molecular weight 569.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,6S,8R,9R,12S,15S,22S)-2,3,23,23,25,25-hexamethyl-8-prop-1-en-2-yl-7,24-dioxa-31-azaoctacyclo[15.14.0.02,15.03,12.06,11.018,30.020,28.022,27]hentriaconta-1(17),10,18(30),19,26,28-hexaene-9,12-diol
Also Known As: Janthitrem C, (2S,3R,6S,8R,9R,12S,15S,22S)-2,3,23,23,25,25-hexamethyl-8-prop-1-en-2-yl-7,24-dioxa-31-azaoctacyclo[15.14.0.02,15.03,12.06,11.018,30.020,28.022,27]hentriaconta-1(17),10,18(30),19,26,28-hexaene-9,12-diol, (2R,3R,4bS,6aS,9aS,15bS,15cR,17aS)-10,10,12,12,15b,15c-Hexamethyl-2-(prop-1-en-2-yl)-2,3,5,6,6a,7,9,9a,10,12,15,15b,15c,16,17,17a-hexadecahydro-4bH-[1]benzopyrano[5',6':6,7]indeno[1,2-b]pyrano[4',3':3,4]cyclopenta[1,2-f]indole-3,4b-diol, (2S,3R,6S,8R,9R,12S,15S,22S)-2,3,23,23,25,25-hexamethyl-8-(prop-1-en-2-yl)-7,24-dioxa-31-azaoctacyclo[15.14.0.02,15.03,12.06,11.018,30.020,28.022,27]hentriaconta-1(17),10,18,20(28),26,29-hexaene-9,12-diol, (2S,3R,6S,8R,9R,12S,15S,22S)-2,3,23,23,25,25-hexamethyl-8-prop-1-en-2-yl-7,24-dioxa-31-azaoctacyclo(15.14.0.02,15.03,12.06,11.018,30.020,28.022,27)hentriaconta-1(17),10,18(30),19,26,28-hexaene-9,12-diol
| Molecular Formula | C37H47NO4 |
|---|---|
| Molecular Weight | 569.35 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 569.3505 |
| Heavy Atoms | 42 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 73561-91-8 |
|---|---|
| SMILES | CC(=C)[C@@H]1[C@@H](C=C2[C@@H](O1)CC[C@]3([C@]2(CC[C@@H]4[C@@]3(C5=C(C4)C6=C(N5)C=C7C(=C6)C[C@H]8C7=CC(OC8(C)C)(C)C)C)O)C)O |
| InChIKey | HVLXXQDJGPKVMK-NCVKUBNTSA-N |
Product Overview
Janthitrem C (CAS 73561-91-8), with molecular formula C37H47NO4 and molecular weight 569.35 g/mol. IUPAC: (2S,3R,6S,8R,9R,12S,15S,22S)-2,3,23,23,25,25-hexamethyl-8-prop-1-en-2-yl-7,24-dioxa-31-azaoctacyclo[15.14.0.02,15.03,12.06,11.018,30.020,28.022,27]hentriaconta-1(17),10,18(30),19,26,28-hexaene-9,12-diol.
Chemical Property Profile of Janthitrem C
Property Insights of Janthitrem C
The XLogP value of 5.0 indicates that Janthitrem C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Janthitrem C. Following Lipinski's Rule of Five, Janthitrem C has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Janthitrem C?
The CAS number of Janthitrem C is 73561-91-8.
What is the molecular formula of Janthitrem C?
The molecular formula of Janthitrem C is C37H47NO4.
What is the molecular weight of Janthitrem C?
The molecular weight of Janthitrem C is 569.35 g/mol.
Where can I buy Janthitrem C?
You can request a quote for Janthitrem C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Janthitrem C?
Yes, KEHONG BIO provides custom synthesis services for Janthitrem C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.