Metabolite

KNApSAcK Entry

id C00034639
Name Pitipeptolide B
CAS RN 334706-27-3
Standard InChI InChI=1S/C44H67N5O9/c1-11-14-16-23-33-44(8,9)43(56)47-35(27(4)5)40(53)48(10)32(25-30-20-17-15-18-21-30)42(55)58-37(29(7)13-3)41(54)49-24-19-22-31(49)38(51)46-36(28(6)12-2)39(52)45-26-34(50)57-33/h11,15,17-18,20-21,27-29,31-33,35-37H,1,12-14,16,19,22-26H2,2-10H3,(H,45,52)(H,46,51)(H,47,56)/t28-,29-,31-,32-,33?,35-,36-,37?/m0/s1
Standard InChI (Main Layer) InChI=1S/C44H67N5O9/c1-11-14-16-23-33-44(8,9)43(56)47-35(27(4)5)40(53)48(10)32(25-30-20-17-15-18-21-30)42(55)58-37(29(7)13-3)41(54)49-24-19-22-31(49)38(51)46-36(28(6)12-2)39(52)45-26-34(50)57-33/h11,15,17-18,20-21,27-29,31-33,35-37H,1,12-14,16,19,22-26H2,2-10H3,(H,45,52)(H,46,51)(H,47,56)

Cluster

Phytochemical cluster
KCF-S cluster No. 1460

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL505027 CHEMBL1902777

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Lyngbya majuscula 158786 Bacteria

Human Protein / Gene in interaction

6 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein CHEMBL1902777 CHEMBL2114784 (1)
1 / 1
P00747 Plasminogen S1A CHEMBL505027 CHEMBL950682 (1)
1 / 2
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein CHEMBL1902777 CHEMBL1794584 (1)
2 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor CHEMBL1902777 CHEMBL2114788 (1)
0 / 0
P00734 Prothrombin S1A CHEMBL505027 CHEMBL950680 (1)
4 / 2
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme CHEMBL1902777 CHEMBL2354311 (1)
1 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (9)

OMIM preferred title UniProt
#114500 Colorectal cancer; crc P84022
#137800 Glioma susceptibility 1; glm1 O75874
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#217090 Plasminogen deficiency, type i P00747
#614390 Pregnancy loss, recurrent, susceptibility to, 2; rprgl2 P00734
#613679 Prothrombin deficiency, congenital P00734
#183090 Spinocerebellar ataxia 2; sca2 Q99700
#601367 Stroke, ischemic P00734
#188050 Thrombophilia due to thrombin defect; thph1 P00734

KEGG DISEASE (4)

KEGG disease name UniProt
H00223 Inherited thrombophilia P00734 (related)
P00747 (related)
H01254 Congenital prothrombin deficiency P00734 (related)
H01206 Plasminogen deficiency P00747 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)