KNApSAcK Metabolite C00000190
Metabolite
KNApSAcK Entry
| id | C00000190 |
|---|---|
| Name | 28-Homocastasterone / 24-S-24-Ethylbrassinone |
| CAS RN | 83509-42-6 |
| Standard InChI | InChI=1S/C29H50O5/c1-7-17(15(2)3)27(34)26(33)16(4)19-8-9-20-18-12-23(30)22-13-24(31)25(32)14-29(22,6)21(18)10-11-28(19,20)5/h15-22,24-27,31-34H,7-14H2,1-6H3/t16-,17-,18-,19+,20-,21-,22+,24-,25+,26+,27+,28+,29+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C29H50O5/c1-7-17(15(2)3)27(34)26(33)16(4)19-8-9-20-18-12-23(30)22-13-24(31)25(32)14-29(22,6)21(18)10-11-28(19,20)5/h15-22,24-27,31-34H,7-14H2,1-6H3 |
Cluster
| Phytochemical cluster | No. 11 |
|---|---|
| KCF-S cluster | No. 68 |
Link
ChEMBL
| By standard InChI | CHEMBL488432 |
|---|---|
| By standard InChI Main Layer | CHEMBL488432 CHEMBL1801920 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C070164 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 2 |
| Viridiplantae | 1 |
| asterids | 1 |
Family
| family name | count |
|---|---|
| Brassicaceae | 2 |
| Hydrodictyaceae | 1 |
| Theaceae | 1 |
List (4)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Brassica campestris | 145471 | Brassicaceae | rosids | Viridiplantae |
| Brassica campestris var. pekinensis L. | 3705 | Brassicaceae | rosids | Viridiplantae |
| Hydrodictyon reticulatum | 3107 | Hydrodictyaceae | Viridiplantae | Viridiplantae |
| Thea sinensis | 4442 | Theaceae | asterids | Viridiplantae |
Human Protein / Gene in interaction
CTD interaction (17)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| C070164 | 596 |
BCL2
Bcl-2 PPP1R50 |
B-cell CLL/lymphoma 2 | homocastasterone results in decreased expression of BCL2 protein |
decreases expression
|
protein |
20833159
|
| C070164 | 598 |
BCL2L1
BCL-XL/S BCL2L BCLX BCLXL BCLXS Bcl-X PPP1R52 bcl-xL bcl-xS |
BCL2-like 1 | homocastasterone results in decreased expression of BCL2L1 protein |
decreases expression
|
protein |
20833159
|
| C070164 | 637 |
BID
FP497 |
BH3 interacting domain death agonist | homocastasterone results in decreased expression of BID protein |
decreases expression
|
protein |
20833159
|
| C070164 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | homocastasterone results in increased expression of CASP3 protein modified form |
increases expression
|
protein |
20833159
|
| C070164 | 891 |
CCNB1
CCNB |
cyclin B1 | homocastasterone results in decreased expression of CCNB1 protein |
decreases expression
|
protein |
20833159
|
| C070164 | 1017 |
CDK2
p33(CDK2) |
cyclin-dependent kinase 2 (EC:2.7.11.22) | homocastasterone results in decreased expression of CDK2 protein |
decreases expression
|
protein |
20833159
|
| C070164 | 1019 |
CDK4
CMM3 PSK-J3 |
cyclin-dependent kinase 4 (EC:2.7.11.22) | homocastasterone results in decreased expression of CDK4 protein |
decreases expression
|
protein |
20833159
|
| C070164 | 1026 |
CDKN1A
CAP20 CDKN1 CIP1 MDA-6 P21 SDI1 WAF1 p21CIP1 |
cyclin-dependent kinase inhibitor 1A (p21, Cip1) | homocastasterone results in increased expression of CDKN1A protein |
increases expression
|
protein |
20833159
|
| C070164 | 1027 |
CDKN1B
CDKN4 KIP1 MEN1B MEN4 P27KIP1 |
cyclin-dependent kinase inhibitor 1B (p27, Kip1) | homocastasterone results in increased expression of CDKN1B protein |
increases expression
|
protein |
20833159
|
| C070164 | 2099 |
ESR1
ER ESR ESRA ESTRR Era NR3A1 |
estrogen receptor 1 | homocastasterone affects the localization of ESR1 protein |
affects localization
|
protein |
20833159
|
| C070164 | 2099 |
ESR1
ER ESR ESRA ESTRR Era NR3A1 |
estrogen receptor 1 | homocastasterone results in decreased expression of ESR1 |
decreases expression
|
20833159
|
|
| C070164 | 2100 |
ESR2
ER-BETA ESR-BETA ESRB ESTRB Erb NR3A2 |
estrogen receptor 2 (ER beta) | homocastasterone affects the localization of ESR2 protein |
affects localization
|
protein |
20833159
|
| C070164 | 2100 |
ESR2
ER-BETA ESR-BETA ESRB ESTRB Erb NR3A2 |
estrogen receptor 2 (ER beta) | homocastasterone results in decreased expression of ESR2 |
decreases expression
|
20833159
|
|
| C070164 | 4193 |
MDM2
ACTFS HDMX hdm2 |
MDM2 oncogene, E3 ubiquitin protein ligase | homocastasterone results in decreased expression of MDM2 protein |
decreases expression
|
protein |
20833159
|
| C070164 | 5925 |
RB1
OSRC RB p105-Rb pRb pp110 |
retinoblastoma 1 | homocastasterone results in decreased expression of RB1 protein |
decreases expression
|
protein |
20833159
|
| C070164 | 5925 |
RB1
OSRC RB p105-Rb pRb pp110 |
retinoblastoma 1 | homocastasterone results in decreased expression of RB1 protein modified form |
decreases expression
|
protein |
20833159
|
| C070164 | 7157 |
TP53
BCC7 LFS1 P53 TRP53 |
tumor protein p53 | homocastasterone results in increased expression of TP53 protein |
increases expression
|
protein |
20833159
|