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(-)-5-Hydroxythalmine structure
Fine Chemical

(-)-5-Hydroxythalmine

TL;DR: (-)-5-Hydroxythalmine (CAS 115301-97-8) is a chemical compound with molecular formula C37H40N2O7 and molecular weight 624.28357 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(12S,25S)-5,20,31-trimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3(8),4,6,14(36),15,17(35),19,21,23(34),29,32-dodecaene-4,30-diol

Also Known As: 5-Hydroxythalmine, (-)-5-Hydroxythalmine, KST-1A0717, J2.417.687H, (12s,25s)-5,20,31-trimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3,5,7,14,16,19(34),20,22,29,32,35-dodecaene-4,30-diol (non-preferred name)

CAS Number
115301-97-8
Molecular Formula
C37H40N2O7
Molecular Weight
624.28357 g/mol
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Technical Specifications

Molecular FormulaC37H40N2O7
Molecular Weight624.28357 g/mol
XLogP6.0
Topological Polar Surface Area (TPSA)93.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors9
Rotatable Bonds3
Exact Mass624.28357 Da
Heavy Atoms46
Complexity997.0
SMILESCN1CCC2=C3C(=C(C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@H]6C7=CC(=C(C(=C7CCN6C)O)OC)O3)OC)OC)O
InChIKeyAJJJRLMIDHHVRN-VMPREFPWSA-N

Chemical Property Profile of (-)-5-Hydroxythalmine

XLogP
6.0
TPSA (Topological Polar Surface Area)
93.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
9
Rotatable Bonds
3
Heavy Atoms
46
Complexity
997.0
Exact Mass
624.28357
Monoisotopic Mass
624.28357
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (-)-5-Hydroxythalmine

The XLogP value of 6.0 indicates that (-)-5-Hydroxythalmine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (-)-5-Hydroxythalmine. Following Lipinski's Rule of Five, (-)-5-Hydroxythalmine has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (-)-5-Hydroxythalmine?

The CAS number of (-)-5-Hydroxythalmine is 115301-97-8.

What is the molecular formula of (-)-5-Hydroxythalmine?

The molecular formula of (-)-5-Hydroxythalmine is C37H40N2O7.

What is the molecular weight of (-)-5-Hydroxythalmine?

The molecular weight of (-)-5-Hydroxythalmine is 624.28357 g/mol.

Where can I buy (-)-5-Hydroxythalmine?

You can request a quote for (-)-5-Hydroxythalmine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (-)-5-Hydroxythalmine?

Yes, CoreyChem provides custom synthesis services for (-)-5-Hydroxythalmine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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