Tetrahydroechinocandin B | CAS#54651-06-8 | cyclic hexapeptide

MedKoo Cat#: 596628 | Name: Tetrahydroechinocandin B

Description:

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

Tetrahydroechinocandin B is a cyclic hexapeptide containing fatty acyl side chain; inhibits 1,3-beta-D-glucan synthesis.

Chemical Structure

Tetrahydroechinocandin B

CAS#54651-06-8

Theoretical Analysis

MedKoo Cat#: 596628

Name: Tetrahydroechinocandin B

CAS#: 54651-06-8

Chemical Formula: C52H85N7O16

Exact Mass: 1063.6053

Molecular Weight: 1064.28

Elemental Analysis: C, 58.68; H, 8.05; N, 9.21; O, 24.05

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.

Bulk Inquiry

Related CAS #

No Data

Synonym

Tetrahydroechinocandin B; L 687,901; L-687,901; L687,901; L-687901; L 687901; L687901;

IUPAC/Chemical Name

N-(23-(1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,12,15-tetrahydroxy-6,20-bis(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-9-yl)stearamide

InChi Key

CSFSSKWGOYOSPM-UHFFFAOYSA-N

InChi Code

InChI=1S/C52H85N7O16/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-38(65)53-35-26-37(64)48(71)57-50(73)42-43(66)29(2)27-59(42)52(75)40(31(4)61)55-49(72)41(45(68)44(67)32-21-23-33(62)24-22-32)56-47(70)36-25-34(63)28-58(36)51(74)39(30(3)60)54-46(35)69/h21-24,29-31,34-37,39-45,48,60-64,66-68,71H,5-20,25-28H2,1-4H3,(H,53,65)(H,54,69)(H,55,72)(H,56,70)(H,57,73)

SMILES Code

CCCCCCCCCCCCCCCCCC(NC1CC(O)C(O)NC(C2C(O)C(C)CN2C(C(C(O)C)NC(C(C(O)C(O)c3ccc(O)cc3)NC(C4CC(O)CN4C(C(C(O)C)NC1=O)=O)=O)=O)=O)=O)=O

Appearance

Solid powder

Purity

>98% (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

>2 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 1,064.28 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: Bocking SP, Wiebe MG, Robson GD, Hansen K, Christiansen LH, Trinci AP. Effect of branch frequency in Aspergillus oryzae on protein secretion and culture viscosity. Biotechnol Bioeng. 1999 Dec 20;65(6):638-48. PubMed PMID: 10550770. 2: Bartizal K, Abruzzo G, Trainor C, Krupa D, Nollstadt K, Schmatz D, Schwartz R, Hammond M, Balkovec J, Vanmiddlesworth F. In vitro antifungal activities and in vivo efficacies of 1,3-beta-D-glucan synthesis inhibitors L-671,329, L-646,991, tetrahydroechinocandin B, and L-687,781, a papulacandin. Antimicrob Agents Chemother. 1992 Aug;36(8):1648-57. PubMed PMID: 1416847; PubMed Central PMCID: PMC192025.