PCIDB

KNApSAcK Metabolite C00003011

Metabolite

KNApSAcK Entry

id C00003011
Name Paeoniflorin
CAS RN 23180-57-6
Standard InChI InChI=1S/C23H28O11/c1-20-9-22(29)13-7-23(20,32-18-16(27)15(26)14(25)12(8-24)31-18)21(13,19(33-20)34-22)10-30-17(28)11-5-3-2-4-6-11/h2-6,12-16,18-19,24-27,29H,7-10H2,1H3/t12?,13-,14-,15+,16?,18+,19-,20+,21+,22-,23+/m1/s1
Standard InChI (Main Layer) InChI=1S/C23H28O11/c1-20-9-22(29)13-7-23(20,32-18-16(27)15(26)14(25)12(8-24)31-18)21(13,19(33-20)34-22)10-30-17(28)11-5-3-2-4-6-11/h2-6,12-16,18-19,24-27,29H,7-10H2,1H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1566

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1078549 CHEMBL1397567 CHEMBL1972762

KEGG

By LinkDB C09959

CTD

By CAS RN C015423

Human Protein / Gene in interaction

4 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P00352 Retinal dehydrogenase 1 Enzyme CHEMBL1397567 CHEMBL1614458 (1)
0 / 0
P03372 Estrogen receptor NR3A1 CHEMBL1078549 CHEMBL1941568 (1) CHEMBL1941569 (1)
1 / 1
O00255 Menin Unclassified protein CHEMBL1397567 CHEMBL1614257 (1)
2 / 5
Q03164 Histone-lysine N-methyltransferase 2A Enzyme CHEMBL1397567 CHEMBL1614257 (1)
1 / 3

CTD interaction (4)

compound gene gene name gene description interaction interaction type form reference
pmid
C015423 664 BNIP3
NIP3
BCL2/adenovirus E1B 19kDa interacting protein 3 peoniflorin inhibits the reaction [cobaltous chloride results in increased expression of BNIP3 mRNA] decreases reaction
/ increases expression
mRNA 22269387
C015423 3091 HIF1A
HIF-1A
HIF-1alpha
HIF1
HIF1-ALPHA
MOP1
PASD8
bHLHe78
hypoxia inducible factor 1, alpha subunit (basic helix-loop-helix transcription factor) peoniflorin inhibits the reaction [[cobaltous chloride results in decreased abundance of Oxygen] which results in increased expression of HIF1A mRNA] decreases abundance
/ decreases reaction
/ increases expression
mRNA 22269387
C015423 3091 HIF1A
HIF-1A
HIF-1alpha
HIF1
HIF1-ALPHA
MOP1
PASD8
bHLHe78
hypoxia inducible factor 1, alpha subunit (basic helix-loop-helix transcription factor) peoniflorin inhibits the reaction [[cobaltous chloride results in decreased abundance of Oxygen] which results in increased expression of HIF1A protein] decreases abundance
/ decreases reaction
/ increases expression
protein 22269387
C015423 7157 TP53
BCC7
LFS1
P53
TRP53
tumor protein p53 peoniflorin inhibits the reaction [cobaltous chloride results in increased expression of TP53 mRNA] decreases reaction
/ increases expression
mRNA 22269387

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (4)

OMIM preferred title UniProt
#615363 Estrogen resistance; estrr P03372
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#145000 Hyperparathyroidism 1; hrpt1 O00255
#131100 Multiple endocrine neoplasia, type i; men1 O00255

KEGG DISEASE (8)

KEGG disease name UniProt
H00033 Adrenal carcinoma O00255 (related)
H00034 Carcinoid O00255 (related)
H00045 Malignant islet cell carcinoma O00255 (related)
H00246 Primary hyperparathyroidism O00255 (related)
H01102 Pituitary adenomas O00255 (related)
H00026 Endometrial Cancer P03372 (marker)
H00001 Acute lymphoblastic leukemia (ALL) (precursor B lymphoblastic leukemia) Q03164 (related)
Q03164 (marker)
H00002 Acute lymphoblastic leukemia (ALL) (precursor T lymphoblastic leukemia) Q03164 (related)

Diseases related to CTD interactions

2 disease from interactions of metabolites

MeSH disease OMIM compound disease name evidence type reference
pmid
D000647 C015423 Amnesia therapeutic
9853408
D007022 C015423 Hypotension therapeutic
10549407