CHEBI:47951 - primary fluorescent chlorophyll catabolite

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name primary fluorescent chlorophyll catabolite
ChEBI ID CHEBI:47951
Definition A member of the class of bilenes that is red chlorophyll catabolite in which a methylene group is introduced at position 1 via the reduction of a double bond. It is an intermediate of chlorophyll breakdown in plants.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C35H40N4O7
Net Charge 0
Average Mass 628.71486
Monoisotopic Mass 628.28970
InChI InChI=1S/C35H40N4O7/c1-8-19-15(3)26(14-40)36-25(19)13-24-18(6)28-32(38-24)29(30(33(28)43)35(45)46-7)31-21(10-11-27(41)42)17(5)22(37-31)12-23-16(4)20(9-2)34(44)39-23/h9,14,17,21,23,30,36,38H,2,8,10-13H2,1,3-7H3,(H,39,44)(H,41,42)/b31-29-/t17-,21-,23?,30+/m0/s1
InChIKey ULSSSZOYSMVFIJ-NPQUFKRBSA-N
SMILES [H]C(=O)c1[nH]c(Cc2[nH]c3\C([C@@H](C(=O)OC)C(=O)c3c2C)=C2/N=C(CC3NC(=O)C(C=C)=C3C)[C@@H](C)[C@@H]2CCC(O)=O)c(CC)c1C
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing primary fluorescent chlorophyll catabolite (CHEBI:47951) has functional parent bilene-b (CHEBI:36732)
primary fluorescent chlorophyll catabolite (CHEBI:47951) has role plant metabolite (CHEBI:76924)
primary fluorescent chlorophyll catabolite (CHEBI:47951) is a bilenes (CHEBI:36736)
primary fluorescent chlorophyll catabolite (CHEBI:47951) is conjugate acid of primary fluorescent chlorophyll catabolite(1−) (CHEBI:77670)
Incoming (1R)-primary fluorescent chlorophyll catabolite (CHEBI:167883) is a primary fluorescent chlorophyll catabolite (CHEBI:47951)
(1S)-primary fluorescent chlorophyll catabolite (CHEBI:167882) is a primary fluorescent chlorophyll catabolite (CHEBI:47951)
primary fluorescent chlorophyll catabolite(1−) (CHEBI:77670) is conjugate base of primary fluorescent chlorophyll catabolite (CHEBI:47951)
IUPAC Name
3-{(2Z,3S,4S)-5-[(4-ethenyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)methyl]-2-[(5R)-2-[(3-ethyl-5-formyl-4-methyl-1H-pyrrol-2-yl)methyl]-5-methoxycarbonyl-3-methyl-4-oxo-4,5-dihydrocyclopenta[b]pyrrol-6(1H)-ylidene]-4-methyl-3,4-dihydro-2H-pyrrol-3-yl}propanoic acid
Synonyms Sources
(82R,12S,13S)-12-(2-carboxyethyl)-3-ethyl-1-formyl-82-(methoxycarbonyl)-2,7,13,17-tetramethyl-18-vinyl-12,13-dihydro-8,10-ethanobilene-b-81,19(16H)-dione JCBN
pFCC ChEBI
primary FCC ChEBI
Manual Xrefs Databases
21865480 ChemSpider
C18098 KEGG COMPOUND
View more database links
Registry Number Type Source
7679417 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
12223835 PubMed citation Europe PMC
12223836 PubMed citation Europe PMC
17237353 PubMed citation Europe PMC
21037946 PubMed citation Europe PMC
22366162 PubMed citation Europe PMC
26179061 PubMed citation Europe PMC
26498743 PubMed citation Europe PMC
31642651 PubMed citation Europe PMC
9624113 PubMed citation Europe PMC
Last Modified
29 March 2021