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Details

Stereochemistry ABSOLUTE
Molecular Formula C50H81N4O15P
Molecular Weight 1009.1697
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 5
Charge 0

SHOW SMILES / InChI
Structure of CALYCULIN A

SMILES

[H][C@@]1(O[C@]2(C[C@@H](O)[C@H](C)[C@H](C\C=C\C3=COC(=N3)[C@@H](C)CCNC(=O)[C@@H](O)[C@@H](O)[C@H](COC)N(C)C)O2)C(C)(C)[C@H]1OP(O)(O)=O)[C@H](C[C@H](O)[C@H](C)[C@H](O)[C@H](C)\C=C(C)\C(C)=C\C=C\C(C)=C/C#N)OC

InChI

InChIKey=FKAWLXNLHHIHLA-YCBIHMBMSA-N
InChI=1S/C50H81N4O15P/c1-29(20-22-51)16-14-17-30(2)32(4)24-33(5)42(57)35(7)38(55)25-41(65-13)45-46(69-70(61,62)63)49(8,9)50(68-45)26-39(56)34(6)40(67-50)19-15-18-36-27-66-48(53-36)31(3)21-23-52-47(60)44(59)43(58)37(28-64-12)54(10)11/h14-18,20,24,27,31,33-35,37-46,55-59H,19,21,23,25-26,28H2,1-13H3,(H,52,60)(H2,61,62,63)/b16-14+,18-15+,29-20-,30-17+,32-24+/t31-,33+,34-,35-,37-,38-,39+,40-,41-,42+,43-,44-,45+,46-,50+/m0/s1

HIDE SMILES / InChI

Molecular Formula C50H81N4O15P
Molecular Weight 1009.1697
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 15 / 15
E/Z Centers 5
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Signal transduction for nuclear factor-kappa B activation. Proposed location of antioxidant-inhibitable step.
1994 Dec 1
Functional and molecular characterization of the K-Cl cotransporter of Xenopus laevis oocytes.
2001 Aug
Phosphorylation-dependent nucleocytoplasmic shuttling of pancreatic duodenal homeobox-1.
2001 Oct
Alpha1-AR-mediated activation of NKCC in rat cardiomyocytes involves ERK-dependent phosphorylation of the cotransporter.
2004 Apr
Toxin-induced tail phosphorylation of hepatocellular S6 kinase: evidence for a dual involvement of the AMP-activated protein kinase in S6 kinase regulation.
2004 Dec
Diphenyl ditelluride induces hypophosphorylation of intermediate filaments through modulation of DARPP-32-dependent pathways in cerebral cortex of young rats.
2012 Feb
RhoGEF17, a Rho-specific guanine nucleotide exchange factor activated by phosphorylation via cyclic GMP-dependent kinase Iα.
2013 Mar
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:11:38 GMT 2023
Edited
by admin
on Sat Dec 16 09:11:38 GMT 2023
Record UNII
7D07U14TK3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALYCULIN A
MI  
Common Name English
(-)-CALYCULIN A
Common Name English
CALYCULIN A [MI]
Common Name English
Code System Code Type Description
DRUG BANK
DB02860
Created by admin on Sat Dec 16 09:11:38 GMT 2023 , Edited by admin on Sat Dec 16 09:11:38 GMT 2023
PRIMARY
PUBCHEM
5311365
Created by admin on Sat Dec 16 09:11:38 GMT 2023 , Edited by admin on Sat Dec 16 09:11:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID00883097
Created by admin on Sat Dec 16 09:11:38 GMT 2023 , Edited by admin on Sat Dec 16 09:11:38 GMT 2023
PRIMARY
WIKIPEDIA
Calyculin
Created by admin on Sat Dec 16 09:11:38 GMT 2023 , Edited by admin on Sat Dec 16 09:11:38 GMT 2023
PRIMARY
FDA UNII
7D07U14TK3
Created by admin on Sat Dec 16 09:11:38 GMT 2023 , Edited by admin on Sat Dec 16 09:11:38 GMT 2023
PRIMARY
MERCK INDEX
m2996
Created by admin on Sat Dec 16 09:11:38 GMT 2023 , Edited by admin on Sat Dec 16 09:11:38 GMT 2023
PRIMARY Merck Index
CAS
101932-71-2
Created by admin on Sat Dec 16 09:11:38 GMT 2023 , Edited by admin on Sat Dec 16 09:11:38 GMT 2023
PRIMARY