Terminology Service for NFDI4Health
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phelligridimer A

Go to external page http://purl.obolibrary.org/obo/CHEBI_66744

A macrocycle isolated from the fungus Phellinus igniarius and has been shown to exhibit antioxidant activity.

Term info

Label

phelligridimer A

database cross reference
Subsets

3_STAR

charge

0

formula

C52H32O20

has obo namespace

chebi_ontology

id

CHEBI:66744

inchi

InChI=1S/C52H32O20/c53-27-7-3-21(11-29(27)55)47-43-40-18-36(62)42(50(64)72-40)26-16-34(60)32(58)10-20(26)2-6-24-14-38-46(52(66)68-24)44(48(70-38)22-4-8-28(54)30(56)12-22)39-17-35(61)41(49(63)71-39)25-15-33(59)31(57)9-19(25)1-5-23-13-37(69-47)45(43)51(65)67-23/h1-18,43-44,47-48,53-62H/b5-1+,6-2+/t43-,44-,47+,48+/m0/s1

inchikey

CJFXDDUPHVDEGG-WBQDRZHYSA-N

mass

976.79850

monoisotopicmass

976.14869

smiles

Oc1ccc(cc1O)[C@H]1Oc2cc3\C=C\c4cc(O)c(O)cc4-c4c(O)cc(oc4=O)[C@@H]4[C@H](Oc5cc(\C=C\c6cc(O)c(O)cc6-c6c(O)cc(oc6=O)[C@H]1c2c(=O)o3)oc(=O)c45)c1ccc(O)c(O)c1