Calmodulin inhibitors from the fungus Emericella sp. (Record no. 46579)

MARC details
000 -LEADER
fixed length control field 02460nam a2200325Ia 4500
003 - CONTROL NUMBER IDENTIFIER
control field MX-MdCICY
005 - DATE AND TIME OF LATEST TRANSACTION
control field 20250625153852.0
040 ## - CATALOGING SOURCE
Transcribing agency CICY
090 ## - LOCALLY ASSIGNED LC-TYPE CALL NUMBER (OCLC); LOCAL CALL NUMBER (RLIN)
Classification number (OCLC) (R) ; Classification number, CALL (RLIN) (NR) B-12371
008 - FIXED-LENGTH DATA ELEMENTS--GENERAL INFORMATION
fixed length control field 250602s9999 xx |||||s2 |||| ||und|d
245 10 - TITLE STATEMENT
Title Calmodulin inhibitors from the fungus Emericella sp.
490 0# - SERIES STATEMENT
Volume/sequential designation Bioorganic & Medicinal Chemistry, 17(6), p.2167-2174, 2009
520 3# - SUMMARY, ETC.
Summary, etc. Two new xanthones identified as 15-chlorotajixanthone hydrate (1)and 14-methoxytajixanthone (2)were isolated from an Emericella sp. strain 25379 along with shamixanthone (3)and tajixanthone hydrate (4). The stereostructures of 1 and 2 were elucidated by spectroscopic and molecular modeling methods. The absolute configuration at the stereogenic centers of 1 was established according to CD measurements. In the case of 2, however, the absolute configuration at C-20 and C-25 was designated as S and R, respectively, by Mosher ester methodology. Thereafter, the configuration at C-14 and C-15 of 2 was established as S and S, respectively by comparing the optical rotation and 1H-1H coupling constant experimental values with those obtained through molecular modeling calculations at DFT B3LYP/DGDZVP level of theory for diasteroisomers 2a-2d. The activation of the calmodulin-sensitive cAMP phosphodiesterase (PDE1)was inhibited in the presence of 1-4 in a concentration-dependent manner. The effect of compounds 2 (IC50 = 5.54 lM)and 4 (IC50 = 5.62 lM)was comparable with that of chlorpromazine (CPZ; IC50 = 7.26 lM), a well known CaM inhibitor used as a positive control. The inhibition mechanism of both compounds was competitive with respect to CaM according to a kinetic study. A docking analysis with 2 and 4 using the AutoDock 4.0 program revealed that they interacted with CaM in the same pocket as trifluoropiperazine (TFP).
650 14 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name entry element EMERICELLA
650 14 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name entry element 15-CHLOROTAJIXANTHONE HYDRATE
650 14 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name entry element 14-METHOXYTAJIXANTHONE
650 14 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name entry element SHAMIXANTHONE
650 14 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name entry element TAJIXANTHONE HYDRATE
650 14 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name entry element CALMODULIN
650 14 - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name entry element DOCKING
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name Figueroa, M.
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name González, M.C.
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name Rodríguez-Sotres, R.
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name Sosa-Peinado, A.
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name González-Andrade, M.
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name Cerda-García-Rojas, C.M.
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name Mata, R.
856 40 - ELECTRONIC LOCATION AND ACCESS
Uniform Resource Identifier <a href="https://drive.google.com/file/d/1TmqZ5JCdqlo1Z_mMC0OvpQkrP1t2dLe7/view?usp=drivesdk">https://drive.google.com/file/d/1TmqZ5JCdqlo1Z_mMC0OvpQkrP1t2dLe7/view?usp=drivesdk</a>
Public note Para ver el documento ingresa a Google con tu cuenta: @cicy.edu.mx
942 ## - ADDED ENTRY ELEMENTS (KOHA)
Source of classification or shelving scheme Clasificación local
Koha item type Documentos solicitados
Holdings
Lost status Source of classification or shelving scheme Damaged status Not for loan Collection Home library Current library Shelving location Date acquired Total checkouts Full call number Date last seen Price effective from Koha item type
  Clasificación local     Ref1 CICY CICY Documento préstamo interbibliotecario 25.06.2025   B-12371 25.06.2025 25.06.2025 Documentos solicitados