KNApSAcK Metabolite C00005818
Metabolite
KNApSAcK Entry
| id | C00005818 |
|---|---|
| Name | Icariside II / Baohuoside 1 / 3-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
| CAS RN | 113558-15-9 |
| Standard InChI | InChI=1S/C27H30O10/c1-12(2)5-10-16-17(28)11-18(29)19-21(31)26(37-27-23(33)22(32)20(30)13(3)35-27)24(36-25(16)19)14-6-8-15(34-4)9-7-14/h5-9,11,13,20,22-23,27-30,32-33H,10H2,1-4H3/t13?,20-,22?,23-,27-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H30O10/c1-12(2)5-10-16-17(28)11-18(29)19-21(31)26(37-27-23(33)22(32)20(30)13(3)35-27)24(36-25(16)19)14-6-8-15(34-4)9-7-14/h5-9,11,13,20,22-23,27-30,32-33H,10H2,1-4H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 371 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL497293 CHEMBL560116 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C060988 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 3 |
Family
| family name | count |
|---|---|
| Berberidaceae | 3 |
List (3)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Epimedium acuminatum | 253612 | Berberidaceae | eudicotyledons | Viridiplantae |
| Epimedium sagittatum | 253616 | Berberidaceae | eudicotyledons | Viridiplantae |
| Epimedium wushanense | 253611 | Berberidaceae | eudicotyledons | Viridiplantae |
Human Protein / Gene in interaction
2 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| O76074 | cGMP-specific 3',5'-cyclic phosphodiesterase | PDE_5A | CHEMBL497293 |
CHEMBL998833
(1)
|
0 / 0 |
| P51160 | Cone cGMP-specific 3',5'-cyclic phosphodiesterase subunit alpha' | PDE_6C | CHEMBL497293 |
CHEMBL998836
(1)
|
1 / 1 |
CTD interaction (15)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| C060988 | 581 |
BAX
BCL2L4 |
BCL2-associated X protein | baohuoside I results in increased expression of BAX protein |
increases expression
|
protein |
22687635
|
| C060988 | 596 |
BCL2
Bcl-2 PPP1R50 |
B-cell CLL/lymphoma 2 | baohuoside I results in decreased expression of BCL2 protein |
decreases expression
|
protein |
22687635
|
| C060988 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | baohuoside I results in increased activity of CASP3 protein |
increases activity
|
protein |
19289254
|
| C060988 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | baohuoside I results in increased cleavage of CASP3 protein |
increases cleavage
|
protein |
22687635
|
| C060988 | 841 |
CASP8
ALPS2B CAP4 Casp-8 FLICE MACH MCH5 |
caspase 8, apoptosis-related cysteine peptidase (EC:3.4.22.61) | baohuoside I results in increased activity of CASP8 protein |
increases activity
|
protein |
19289254
|
| C060988 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | baohuoside I results in increased activity of CASP9 protein |
increases activity
|
protein |
19289254
|
| C060988 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | baohuoside I results in increased cleavage of CASP9 protein |
increases cleavage
|
protein |
22687635
|
| C060988 | 4843 |
NOS2
HEP-NOS INOS NOS NOS2A |
nitric oxide synthase 2, inducible (EC:1.14.13.39) | baohuoside I results in decreased expression of NOS2 |
decreases expression
|
19289254
|
|
| C060988 | 142 |
PARP1
ADPRT ADPRT_1 ADPRT1 ARTD1 PARP PARP-1 PPOL pADPRT-1 |
poly (ADP-ribose) polymerase 1 (EC:2.4.2.30) | baohuoside I results in increased cleavage of PARP1 protein |
increases cleavage
|
protein |
19289254
22687635 |
| C060988 | 142 |
PARP1
ADPRT ADPRT_1 ADPRT1 ARTD1 PARP PARP-1 PPOL pADPRT-1 |
poly (ADP-ribose) polymerase 1 (EC:2.4.2.30) | Dinoprostone inhibits the reaction [baohuoside I results in increased cleavage of PARP1 protein] |
decreases reaction
/ increases cleavage |
protein |
19289254
|
| C060988 | 142 |
PARP1
ADPRT ADPRT_1 ADPRT1 ARTD1 PARP PARP-1 PPOL pADPRT-1 |
poly (ADP-ribose) polymerase 1 (EC:2.4.2.30) | PTGS2 mutant form promotes the reaction [baohuoside I results in increased cleavage of PARP1 protein] |
increases cleavage
/ increases reaction |
protein |
19289254
|
| C060988 | 5743 |
PTGS2
COX-2 COX2 GRIPGHS PGG/HS PGHS-2 PHS-2 hCox-2 |
prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1) | baohuoside I results in decreased expression of PTGS2 |
decreases expression
|
19289254
|
|
| C060988 | 5743 |
PTGS2
COX-2 COX2 GRIPGHS PGG/HS PGHS-2 PHS-2 hCox-2 |
prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1) | [baohuoside I results in decreased expression of PTGS2] which results in decreased abundance of Dinoprostone |
decreases abundance
/ decreases expression |
19289254
|
|
| C060988 | 5743 |
PTGS2
COX-2 COX2 GRIPGHS PGG/HS PGHS-2 PHS-2 hCox-2 |
prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1) | PTGS2 mutant form promotes the reaction [baohuoside I results in increased cleavage of PARP1 protein] |
increases cleavage
/ increases reaction |
mutant form |
19289254
|
| C060988 | 7422 |
VEGFA
MVCD1 VEGF VPF |
vascular endothelial growth factor A | baohuoside I results in decreased expression of VEGFA |
decreases expression
|
19289254
|