FR179642 hydrate | CAS# 1392483-15-6 | Biochemical

MedKoo Cat#: 574320 | Name: FR179642 hydrate

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Description:

WARNING: This product is for research use only, not for human or veterinary use.

FR179642 is the cyclic peptide nucleus of the lipopeptide antifungal FR901379 and an intermediate in the synthesis of the echinocandin antifungal FK463.

Chemical Structure

FR179642 hydrate

CAS#1392483-15-6 (hydrate)

Theoretical Analysis

MedKoo Cat#: 574320

Name: FR179642 hydrate

CAS#: 1392483-15-6 (hydrate)

Chemical Formula: C35H54N8O21S

Exact Mass: 954.3124

Molecular Weight: 954.91

Elemental Analysis: C, 44.02; H, 5.70; N, 11.73; O, 35.18; S, 3.36

Price and Availability

Size	Price	Availability
5mg	USD 350.00	2 Weeks
10mg	USD 625.00	2 Weeks
25mg	USD 950.00	2 Weeks

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Related CAS #

168110-44-9 (free) 1392483-15-6 (hydrate)

Synonym

FR179642 hydrate; FR179642 ; FR-179642; FR 179642

IUPAC/Chemical Name

5-((1S,2S)-2-((2R,6S,9S,11R,12R,14aS,15S,16S,20S,23S,25aS)-9-amino-20-((R)-3-amino-1-hydroxy-3-oxopropyl)-2,11,12,15-tetrahydroxy-6-((R)-1-hydroxyethyl)-16-methyl-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-23-yl)-1,2-dihydroxyethyl)-2-hydroxyphenyl hydrogen sulfate hydrate

InChi Key

NRZYGLYWNMDXAW-IOAKHOJDSA-N

InChi Code

InChI=1S/C35H52N8O20S.H2O/c1-11-9-43-25(26(11)50)33(57)41-31(55)19(48)7-15(36)29(53)38-22(12(2)44)34(58)42-10-14(45)6-16(42)30(54)40-24(32(56)39-23(35(43)59)18(47)8-21(37)49)28(52)27(51)13-3-4-17(46)20(5-13)63-64(60,61)62;/h3-5,11-12,14-16,18-19,22-28,31,44-48,50-52,55H,6-10,36H2,1-2H3,(H2,37,49)(H,38,53)(H,39,56)(H,40,54)(H,41,57)(H,60,61,62);

SMILES Code

O=C(N[C@]([C@H](O)CC(N)=O)([H])C(N1[C@@](C(N[C@H](O)[C@H](O)C[C@@H]2N)=O)([H])[C@@H](O)[C@@H](C)C1)=O)[C@@]([C@H](O)[C@@H](O)C3=CC=C(O)C(OS(O)(=O)=O)=C3)([H])NC([C@@]4([H])N(C([C@@]([C@H](O)C)([H])NC2=O)=O)C[C@H](O)C4)=O.O

Appearance

Solid powder

Purity

>95% (or refer to the Certificate of Analysis)

Shipping Condition

Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition

Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility

Soluble in DMSO

Shelf Life

>3 years if stored properly

Drug Formulation

This drug may be formulated in DMSO

Stock Solution Storage

0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code

2934.99.9001

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 954.91 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Concentration / Solvent Volume / Mass	1 mg	5 mg	10 mg
1 mM	1.15 mL	5.76 mL	11.51 mL
5 mM	0.23 mL	1.15 mL	2.3 mL
10 mM	0.12 mL	0.58 mL	1.15 mL
50 mM	0.02 mL	0.12 mL	0.23 mL

1. Tomishima, M., Ohki, H., Yamada, A., et al. FK463, a novel water-soluble echinocandin lipopeptide: Synthesis and antifungal activity. J. Antibiot. (Tokyo) 52(7), 674-676 (1999). 2. Ueda, S., Shibata, T., Ito, K., et al. Cloning and expression of the FR901379 acylase gene from Streptomyces sp. no. 6907. J. Antibiot. (Tokyo) 64(2), 169-175 (2011).