PCIDB

KNApSAcK Metabolite C00031300

Metabolite

KNApSAcK Entry

id C00031300
Name Sargachromenol
CAS RN 70363-89-2
Standard InChI InChI=1S/C27H36O4/c1-19(2)9-6-12-22(26(29)30)13-7-10-20(3)11-8-15-27(5)16-14-23-18-24(28)17-21(4)25(23)31-27/h9,11,13-14,16-18,28H,6-8,10,12,15H2,1-5H3,(H,29,30)/b20-11+,22-13+
Standard InChI (Main Layer) InChI=1S/C27H36O4/c1-19(2)9-6-12-22(26(29)30)13-7-10-20(3)11-8-15-27(5)16-14-23-18-24(28)17-21(4)25(23)31-27/h9,11,13-14,16-18,28H,6-8,10,12,15H2,1-5H3,(H,29,30)

Cluster

Phytochemical cluster
KCF-S cluster No. 2359

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1668777 CHEMBL1668778

KEGG

By LinkDB

CTD

By CAS RN

Human Protein / Gene in interaction

7 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P10276 Retinoic acid receptor alpha NR1B1 CHEMBL1668777 CHEMBL1668778 CHEMBL1671298 (2)
1 / 3
P04150 Glucocorticoid receptor NR3C1 CHEMBL1668777 CHEMBL1668778 CHEMBL1671295 (2)
0 / 1
P06401 Progesterone receptor NR3C3 CHEMBL1668777 CHEMBL1668778 CHEMBL1671299 (2)
0 / 1
Q96RI1 Bile acid receptor NR1H4 CHEMBL1668777 CHEMBL1668778 CHEMBL1671292 (2) CHEMBL1671293 (2)
0 / 0
P03372 Estrogen receptor NR3A1 CHEMBL1668777 CHEMBL1668778 CHEMBL1671300 (2)
1 / 1
P08235 Mineralocorticoid receptor NR3C2 CHEMBL1668777 CHEMBL1668778 CHEMBL1671297 (2)
2 / 2
P10275 Androgen receptor NR3C4 CHEMBL1668777 CHEMBL1668778 CHEMBL1671296 (2)
3 / 4

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (7)

OMIM preferred title UniProt
#612376 Acute promyelocytic leukemia; apl P10276
#300068 Androgen insensitivity syndrome; ais P10275
#312300 Androgen insensitivity, partial; pais P10275
#615363 Estrogen resistance; estrr P03372
#605115 Hypertension, early-onset, autosomal dominant, with severe exacerbation in pregnancy P08235
#177735 Pseudohypoaldosteronism, type i, autosomal dominant; pha1a P08235
#313200 Spinal and bulbar muscular atrophy, x-linked 1; smax1 P10275

KEGG DISEASE (10)

KEGG disease name UniProt
H00026 Endometrial Cancer P03372 (marker)
P06401 (marker)
H00599 46,XX disorders of sex development (Disorders related to androgen excess) P04150 (related)
H00243 Hyperkalemic distal renal tubular acidosis (RTA type 4) P08235 (related)
H00603 Hypertension exacerbated in pregnancy P08235 (related)
H00024 Prostate cancer P10275 (related)
H00062 Spinal and bulbar muscular atrophy (SBMA) P10275 (related)
H00608 46,XY disorders of sex development (Disorders in androgen synthesis or action) P10275 (related)
H00609 46,XY disorders of sex development (Other) P10275 (related)
H00003 Acute myeloid leukemia (AML) P10276 (related)
P10276 (marker)
H00516 Isolated orofacial clefts P10276 (related)