PCIDB

KNApSAcK Metabolite C00019807

Metabolite

KNApSAcK Entry

id C00019807
Name Calanolide C
CAS RN 142632-35-7
Standard InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12+,18-/m0/s1
Standard InChI (Main Layer) InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3

Cluster

Phytochemical cluster No. 25
KCF-S cluster No. 891

Link

ChEMBL

By standard InChI CHEMBL263086
By standard InChI Main Layer CHEMBL7187 CHEMBL7121 CHEMBL268207 CHEMBL267447 CHEMBL263086 CHEMBL269063 CHEMBL282382 CHEMBL270362 CHEMBL518356

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 2

Family

family name count
Calophyllaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Calophyllum brasiliense 280748 Calophyllaceae rosids Viridiplantae
Calophyllum lanigerum 999558 Calophyllaceae rosids Viridiplantae

Human Protein / Gene in interaction

26 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein CHEMBL270362 CHEMBL2114784 (1)
1 / 1
P06746 DNA polymerase beta Enzyme CHEMBL267447 CHEMBL984068 (1)
0 / 0
P04062 Glucosylceramidase Enzyme CHEMBL270362 CHEMBL1613818 (1)
6 / 4
P43166 Carbonic anhydrase 7 Lyase CHEMBL7121 CHEMBL2341285 (1)
0 / 0
Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Enzyme CHEMBL270362 CHEMBL1794585 (1)
0 / 0
Q8N1Q1 Carbonic anhydrase 13 Lyase CHEMBL7121 CHEMBL2341282 (1)
0 / 0
P37840 Alpha-synuclein Unclassified protein CHEMBL270362 CHEMBL2354282 (1)
4 / 2
P00918 Carbonic anhydrase 2 Lyase CHEMBL7121 CHEMBL2341286 (1)
1 / 2
P00352 Retinal dehydrogenase 1 Enzyme CHEMBL270362 CHEMBL1614458 (1)
0 / 0
P17405 Sphingomyelin phosphodiesterase Enzyme CHEMBL270362 CHEMBL1794495 (1)
2 / 2
O43570 Carbonic anhydrase 12 Lyase CHEMBL7121 CHEMBL2341283 (1)
1 / 2
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein CHEMBL270362 CHEMBL1794584 (1)
2 / 0
O75496 Geminin Unclassified protein CHEMBL270362 CHEMBL2114843 (1)
0 / 0
P00915 Carbonic anhydrase 1 Lyase CHEMBL7121 CHEMBL2341287 (1)
0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor CHEMBL270362 CHEMBL2114788 (1)
0 / 0
P63092 Guanine nucleotide-binding protein G(s) subunit alpha isoforms short Other membrane protein CHEMBL270362 CHEMBL2114810 (1) CHEMBL2114817 (1)
7 / 3
P83916 Chromobox protein homolog 1 Unclassified protein CHEMBL270362 CHEMBL1794401 (1)
0 / 0
P28482 Mitogen-activated protein kinase 1 Erk CHEMBL270362 CHEMBL1614521 (1)
0 / 0
Q16790 Carbonic anhydrase 9 Lyase CHEMBL7121 CHEMBL2341284 (1)
0 / 1
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein CHEMBL270362 CHEMBL1738588 (1)
0 / 0
Q6W5P4 Neuropeptide S receptor Neuropeptide receptor CHEMBL270362 CHEMBL1614052 (1)
1 / 0
O14727 Apoptotic protease-activating factor 1 Unclassified protein CHEMBL270362 CHEMBL1794319 (1) CHEMBL1794383 (1)
0 / 0
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein CHEMBL270362 CHEMBL1738184 (1)
0 / 0
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme CHEMBL270362 CHEMBL1964002 (1) CHEMBL2354311 (1)
1 / 0
P01215 Glycoprotein hormones alpha chain Unclassified protein CHEMBL270362 CHEMBL2114913 (1)
0 / 3
Q13148 TAR DNA-binding protein 43 Unclassified protein CHEMBL270362 CHEMBL2354287 (1)
1 / 1

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (26)

OMIM preferred title UniProt
#219080 Acth-independent macronodular adrenal hyperplasia; aimah P63092
#612069 Amyotrophic lateral sclerosis 10, with or without frontotemporal dementia; als10 Q13148
#608584 Asthma-related traits, susceptibility to, 2 Q6W5P4
#114500 Colorectal cancer; crc P84022
#127750 Dementia, lewy body; dlb P37840
#608013 Gaucher disease, perinatal lethal P04062
#230800 Gaucher disease, type i P04062
#230900 Gaucher disease, type ii P04062
#231000 Gaucher disease, type iii P04062
#231005 Gaucher disease, type iiic P04062
#137800 Glioma susceptibility 1; glm1 O75874
#143860 Hyperchlorhidrosis, isolated O43570
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#174800 Mccune-albright syndrome; mas P63092
#257200 Niemann-pick disease, type a P17405
#607616 Niemann-pick disease, type b P17405
#166350 Osseous heteroplasia, progressive; poh P63092
#259730 Osteopetrosis, autosomal recessive 3; optb3 P00918
#168601 Parkinson disease 1, autosomal dominant; park1 P37840
#605543 Parkinson disease 4, autosomal dominant; park4 P37840
#168600 Parkinson disease, late-onset; pd P04062
P37840
#102200 Pituitary adenoma, growth hormone-secreting P63092
#103580 Pseudohypoparathyroidism, type ia; php1a P63092
#603233 Pseudohypoparathyroidism, type ib; php1b P63092
#612462 Pseudohypoparathyroidism, type ic; php1c P63092
#183090 Spinocerebellar ataxia 2; sca2 Q99700

KEGG DISEASE (19)

KEGG disease name UniProt
H01302 Hyperchlorhidrosis isolated (HCHLH) O43570 (related)
H00021 Renal cell carcinoma O43570 (marker)
Q16790 (marker)
H00241 Combined proximal and distal renal tubular acidosis (RTA type 3) P00918 (related)
H00436 Osteopetrosis P00918 (related)
H00081 Hashimoto's thyroiditis P01215 (marker)
H00082 Graves' disease P01215 (marker)
H00250 Congenital nongoitrous hypothyroidism (CHNG) P01215 (marker)
H00066 Lewy body dementia (LBD) P04062 (related)
P37840 (related)
H00126 Gaucher disease P04062 (related)
H00426 Defects in the degradation of ganglioside P04062 (related)
H00810 Progressive myoclonic epilepsy (PME) P04062 (related)
H00137 Niemann-Pick disease (NPD) typeA and B P17405 (related)
H00424 Defects in the degradation of sphingomyelin P17405 (related)
H00057 Parkinson's disease (PD) P37840 (related)
H00244 Pseudohypoparathyroidism P63092 (related)
H00441 Progressive osseous heteroplasia (POH) P63092 (related)
H00501 Fibrous dysplasia, polyostotic P63092 (related)
H00058 Amyotrophic lateral sclerosis (ALS) Q13148 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)