KEGG   COMPOUND: C01245
Entry
C01245                      Compound                               

Name
D-myo-Inositol 1,4,5-trisphosphate;
1D-myo-Inositol 1,4,5-trisphosphate;
Inositol 1,4,5-trisphosphate;
Ins(1,4,5)P3
Formula
C6H15O15P3
Exact mass
419.9624
Mol weight
420.0956
Structure
Reaction
Pathway
map00562  Inositol phosphate metabolism
map01100  Metabolic pathways
map04010  MAPK signaling pathway
map04012  ErbB signaling pathway
map04014  Ras signaling pathway
map04020  Calcium signaling pathway
map04022  cGMP-PKG signaling pathway
map04024  cAMP signaling pathway
map04062  Chemokine signaling pathway
map04064  NF-kappa B signaling pathway
map04066  HIF-1 signaling pathway
map04070  Phosphatidylinositol signaling system
map04071  Sphingolipid signaling pathway
map04072  Phospholipase D signaling pathway
map04114  Oocyte meiosis
map04261  Adrenergic signaling in cardiomyocytes
map04270  Vascular smooth muscle contraction
map04370  VEGF signaling pathway
map04371  Apelin signaling pathway
map04380  Osteoclast differentiation
map04540  Gap junction
map04611  Platelet activation
map04621  NOD-like receptor signaling pathway
map04625  C-type lectin receptor signaling pathway
map04650  Natural killer cell mediated cytotoxicity
map04658  Th1 and Th2 cell differentiation
map04659  Th17 cell differentiation
map04660  T cell receptor signaling pathway
map04662  B cell receptor signaling pathway
map04664  Fc epsilon RI signaling pathway
map04666  Fc gamma R-mediated phagocytosis
map04720  Long-term potentiation
map04722  Neurotrophin signaling pathway
map04723  Retrograde endocannabinoid signaling
map04724  Glutamatergic synapse
map04725  Cholinergic synapse
map04726  Serotonergic synapse
map04728  Dopaminergic synapse
map04730  Long-term depression
map04742  Taste transduction
map04745  Phototransduction - fly
map04750  Inflammatory mediator regulation of TRP channels
map04911  Insulin secretion
map04912  GnRH signaling pathway
map04915  Estrogen signaling pathway
map04916  Melanogenesis
map04918  Thyroid hormone synthesis
map04919  Thyroid hormone signaling pathway
map04921  Oxytocin signaling pathway
map04922  Glucagon signaling pathway
map04924  Renin secretion
map04925  Aldosterone synthesis and secretion
map04926  Relaxin signaling pathway
map04927  Cortisol synthesis and secretion
map04928  Parathyroid hormone synthesis, secretion and action
map04929  GnRH secretion
map04933  AGE-RAGE signaling pathway in diabetic complications
map04934  Cushing syndrome
map04935  Growth hormone synthesis, secretion and action
map04961  Endocrine and other factor-regulated calcium reabsorption
map04970  Salivary secretion
map04971  Gastric acid secretion
map04972  Pancreatic secretion
map05010  Alzheimer disease
map05012  Parkinson disease
map05016  Huntington disease
map05017  Spinocerebellar ataxia
map05110  Vibrio cholerae infection
map05131  Shigellosis
map05135  Yersinia infection
map05142  Chagas disease
map05143  African trypanosomiasis
map05146  Amoebiasis
map05163  Human cytomegalovirus infection
map05167  Kaposi sarcoma-associated herpesvirus infection
map05169  Epstein-Barr virus infection
map05170  Human immunodeficiency virus 1 infection
map05200  Pathways in cancer
map05214  Glioma
map05223  Non-small cell lung cancer
map05225  Hepatocellular carcinoma
map05235  PD-L1 expression and PD-1 checkpoint pathway in cancer
Module
M00130  Inositol phosphate metabolism, PI=> PIP2 => Ins(1,4,5)P3 => Ins(1,3,4,5)P4
Enzyme
2.7.1.127       2.7.1.151       3.1.3.56        3.1.3.62        
3.1.4.11
Other DBs
CAS: 85166-31-0
PubChem: 4466
ChEBI: 16595
ChEMBL: CHEMBL279107
KNApSAcK: C00007460
PDB-CCD: I3P[PDBj]
3DMET: B01422
NIKKAJI: J260.291A
LinkDB
KCF data

ATOM        24
            1   P1b P    25.6255  -13.5615
            2   O2b O    25.6194  -14.9145
            3   O1c O    24.3485  -13.5676
            4   O1c O    25.6194  -12.2145
            5   O1c O    26.9724  -13.5615
            6   C1y C    23.3148  -16.4331
            7   C1y C    23.3148  -17.7985
            8   C1y C    22.1294  -15.7627
            9   C1y C    22.1294  -18.4876
            10  O2b O    24.4179  -18.4752
            11  C1y C    20.9624  -16.4331
            12  O1a O    22.1294  -14.6197
            13  C1y C    20.9624  -17.7985
            14  O1a O    22.1294  -19.8406
            15  P1b P    25.7585  -18.4690
            16  O2b O    19.7955  -15.7627
            17  O1a O    19.7894  -18.4690
            18  O1c O    27.1118  -18.4690
            19  O1c O    25.7585  -17.1158
            20  O1c O    25.7585  -19.8158
            21  P1b P    18.4424  -15.7503
            22  O1c O    17.0955  -15.7503
            23  O1c O    18.3785  -14.3334
            24  O1c O    18.4361  -17.1034
BOND        24
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 2
            5     6   2 1 #Up
            6     6   7 1
            7     6   8 1
            8     7   9 1
            9     7  10 1 #Down
            10    8  11 1
            11    8  12 1 #Down
            12    9  13 1
            13    9  14 1 #Up
            14   10  15 1
            15   11  16 1 #Up
            16   13  17 1 #Up
            17   15  18 1
            18   15  19 1
            19   15  20 2
            20   16  21 1
            21   21  22 1
            22   21  23 1
            23   21  24 2
            24   11  13 1

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