PCIDB

KNApSAcK Metabolite C00000642

Metabolite

KNApSAcK Entry

id C00000642
Name (+)-Yangambin
CAS RN 13060-14-5
Standard InChI InChI=1S/C24H30O8/c1-25-17-7-13(8-18(26-2)23(17)29-5)21-15-11-32-22(16(15)12-31-21)14-9-19(27-3)24(30-6)20(10-14)28-4/h7-10,15-16,21-22H,11-12H2,1-6H3/t15-,16-,21+,22+/m0/s1
Standard InChI (Main Layer) InChI=1S/C24H30O8/c1-25-17-7-13(8-18(26-2)23(17)29-5)21-15-11-32-22(16(15)12-31-21)14-9-19(27-3)24(30-6)20(10-14)28-4/h7-10,15-16,21-22H,11-12H2,1-6H3

Cluster

Phytochemical cluster No. 21
KCF-S cluster No. 38

Link

ChEMBL

By standard InChI CHEMBL454592
By standard InChI Main Layer CHEMBL510536 CHEMBL454592 CHEMBL1412125

KEGG

By LinkDB C10894

CTD

By CAS RN

Species

Summary

Plant class

class name count
Magnoliophyta 12
rosids 7
asterids 5

Family (Top 10)

family name count
Magnoliaceae 5
Asteraceae 4
Rutaceae 2
Lauraceae 2
Myristicaceae 2
Malvaceae 1
Polygalaceae 1
Annonaceae 1
Lamiaceae 1
Myrtaceae 1

List (24)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Achillea holosericea 282740 Asteraceae asterids Viridiplantae
Acronychia laurifolia 43714 Rutaceae rosids Viridiplantae
Aglaia leptantha 201006 Meliaceae rosids Viridiplantae
Artemisia absinthium 72332 Asteraceae asterids Viridiplantae
Artemisia arborescens 72386 Asteraceae asterids Viridiplantae
Artemisia argentea 669119 Asteraceae asterids Viridiplantae
Cassytha filiformis 121073 Lauraceae Magnoliophyta Viridiplantae
Clerodendron brachyanthum 13432 Lamiaceae asterids Viridiplantae
Eriosema chinense 109225 Fabaceae rosids Viridiplantae
Eucalyptus citriodora 34329 Myrtaceae rosids Viridiplantae
Firmiana platanifolia 190243 Malvaceae rosids Viridiplantae
Hernandia ovigera 13561 Hernandiaceae Magnoliophyta Viridiplantae
Liriodendron tulipifera 3415 Magnoliaceae Magnoliophyta Viridiplantae
Magnolia biondii 86725 Magnoliaceae Magnoliophyta Viridiplantae
Magnolia denudata 85856 Magnoliaceae Magnoliophyta Viridiplantae
Magnolia fargesii 3402 Magnoliaceae Magnoliophyta Viridiplantae
Magnolia kobus var. borealis 3402 Magnoliaceae Magnoliophyta Viridiplantae
Ocotea duckei 63801 Lauraceae Magnoliophyta Viridiplantae
Piper guineense 511543 Piperaceae Magnoliophyta Viridiplantae
Polygala gazensis 4275 Polygalaceae rosids Viridiplantae
Rollinia mucosa 301699 Annonaceae Magnoliophyta Viridiplantae
Virola elongata 224865 Myristicaceae Magnoliophyta Viridiplantae
Virola peruviana 224865 Myristicaceae Magnoliophyta Viridiplantae
Zanthoxylum leprieurii 992815 Rutaceae rosids Viridiplantae

Human Protein / Gene in interaction

4 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein CHEMBL1412125 CHEMBL1794584 (1)
2 / 0
O75496 Geminin Unclassified protein CHEMBL1412125 CHEMBL2114843 (1)
0 / 0
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein CHEMBL1412125 CHEMBL1738588 (1)
0 / 0
Q9UBT6 DNA polymerase kappa Enzyme CHEMBL1412125 CHEMBL1794536 (1)
0 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (2)

OMIM preferred title UniProt
#114500 Colorectal cancer; crc P84022
#613795 Loeys-dietz syndrome, type 3; lds3 P84022