CHEBI:65369 - acumitin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name acumitin
ChEBI ID CHEBI:65369
Definition A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1 and 3, a 2-hydroxybenzyl group at position 2 and a 3-phenylpropanoyl group at position 4. It is isolated from the roots of Uvaria acuminata and exhibits potent cytotoxicity against human promyelocytic leukemia HL-60 cells.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C29H22O6
Net Charge 0
Average Mass 466.48140
Monoisotopic Mass 466.14164
InChI InChI=1S/C29H22O6/c30-21-12-6-4-10-18(21)16-20-27(33)24(22(31)15-14-17-8-2-1-3-9-17)29-25(28(20)34)26(32)19-11-5-7-13-23(19)35-29/h1-13,30,33-34H,14-16H2
InChIKey NIFSYUFGZVWGGD-UHFFFAOYSA-N
SMILES Oc1ccccc1Cc1c(O)c(C(=O)CCc2ccccc2)c2oc3ccccc3c(=O)c2c1O
Metabolite of Species Details
Uvaria acuminata (NCBI:txid672960) Found in root (BTO:0001188). See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing acumitin (CHEBI:65369) has role antineoplastic agent (CHEBI:35610)
acumitin (CHEBI:65369) has role metabolite (CHEBI:25212)
acumitin (CHEBI:65369) is a dihydrochalcones (CHEBI:71230)
acumitin (CHEBI:65369) is a phenols (CHEBI:33853)
acumitin (CHEBI:65369) is a xanthones (CHEBI:51149)
IUPAC Name
1,3-dihydroxy-2-(2-hydroxybenzyl)-4-(3-phenylpropanoyl)-9H-xanthen-9-one
Registry Number Type Source
9740342 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
14709883 PubMed citation Europe PMC
Last Modified
01 March 2013