CHEBI:132345 - canophyllal

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ChEBI Name canophyllal
ChEBI ID CHEBI:132345
Definition A pentacyclic triterpenoid with formula C30H48O2, originally isolated from the leaves of Syzygium formosanum.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter qingping liu
Supplier Information
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Formula C30H48O2
Net Charge 0
Average Mass 440.702
Monoisotopic Mass 440.36543
InChI InChI=1S/C30H48O2/c1-20-21(32)8-9-22-26(20,4)11-10-23-27(22,5)13-14-29(7)24-18-25(2,3)12-16-30(24,19-31)17-15-28(23,29)6/h19-20,22-24H,8-18H2,1-7H3/t20-,22+,23-,24-,26+,27-,28+,29-,30+/m0/s1
InChIKey ONRNCDHSZVITNY-TWWFCBCGSA-N
SMILES [C@]12([C@]([C@]3([C@@](CC1)(CCC(C3)(C)C)C(=O)[H])[H])(CC[C@@]4([C@@]2(CC[C@]5([C@]4(CCC([C@@H]5C)=O)[H])C)[H])C)C)C
Metabolite of Species Details
Calophyllum inophyllum (NCBI:txid158927) Found in stem (BTO:0001300). See: PubMed
Syzygium formosanum. (NCBI:txid1609897) See: PubMed
Tripterygium hypoglaucum (NCBI:txid205465) Found in root (BTO:0001188). See: PubMed
Endodesmia calophylloides (NCBI:txid279256) Found in stem (BTO:0001300). See: PubMed
Alchornea cordifolia (NCBI:txid316697) Found in root (BTO:0001188). See: PubMed
Alchornea cordifolia (NCBI:txid316697) Found in stem (BTO:0001300). See: PubMed
Tripterygium wilfordii (NCBI:txid458696) Found in root (BTO:0001188). See: PubMed
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.
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing canophyllal (CHEBI:132345) has parent hydride friedelane (CHEBI:71575)
canophyllal (CHEBI:132345) has role antibacterial agent (CHEBI:33282)
canophyllal (CHEBI:132345) has role plant metabolite (CHEBI:76924)
canophyllal (CHEBI:132345) is a aliphatic aldehyde (CHEBI:59768)
canophyllal (CHEBI:132345) is a cyclic terpene ketone (CHEBI:36130)
canophyllal (CHEBI:132345) is a pentacyclic triterpenoid (CHEBI:25872)
IUPAC Name
(4aS,6aR,6bS,8aS,9R,12aS,12bS,14aS,14bS)-2,2,6a,8a,9,12b,14a-heptamethyl-10-oxoicosahydropicene-4a(2H)-carbaldehyde
Synonyms Sources
3-oxofriedelan-28-al ChEBI
friedelane-3-one-28-al ChEBI
Registry Number Type Source
3110516 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10075776 PubMed citation Europe PMC
11849847 PubMed citation Europe PMC
16864458 PubMed citation Europe PMC
17487607 PubMed citation Europe PMC
18310952 PubMed citation Europe PMC
20188156 PubMed citation Europe PMC
22256754 PubMed citation Europe PMC
26724423 PubMed citation Europe PMC
Last Modified
24 October 2016