PCIDB

KNApSAcK Metabolite C00029677

Metabolite

KNApSAcK Entry

id C00029677
Name Alphitolic acid
CAS RN 19533-92-7
Standard InChI InChI=1S/C30H48O4/c1-17(2)18-10-13-30(25(33)34)15-14-28(6)19(23(18)30)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h18-24,31-32H,1,8-16H2,2-7H3,(H,33,34)/t18-,19+,20+,21-,22+,23+,24-,27-,28+,29+,30-/m0/s1
Standard InChI (Main Layer) InChI=1S/C30H48O4/c1-17(2)18-10-13-30(25(33)34)15-14-28(6)19(23(18)30)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h18-24,31-32H,1,8-16H2,2-7H3,(H,33,34)

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 23

Link

ChEMBL

By standard InChI CHEMBL511805
By standard InChI Main Layer CHEMBL511805

KEGG

By LinkDB C16912

CTD

By CAS RN

Human Protein / Gene in interaction

1 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P08151 Zinc finger protein GLI1 Unclassified protein CHEMBL511805 CHEMBL972431 (1) CHEMBL987100 (2)
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