CHEBI:221735 - Xenocockiamide C

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Xenocockiamide C
ChEBI ID CHEBI:221735
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C36H34N2O2
Net Charge 0
Average Mass 526.680
Monoisotopic Mass 526.26203
InChI InChI=1S/C36H34N2O2/c39-35(23-21-29-13-5-1-6-14-29)37-27-34(26-32-19-11-4-12-20-32)38(28-33(37)25-31-17-9-3-10-18-31)36(40)24-22-30-15-7-2-8-16-30/h1-24,33-34H,25-28H2/b23-21+,24-22+/t33-,34-/m0/s1
InChIKey AWQXJSOSRXEKTN-XSXTWHRJSA-N
SMILES O=C(N1[C@H](CN(C(=O)/C=C/C2=CC=CC=C2)[C@H](C1)CC3=CC=CC=C3)CC4=CC=CC=C4)/C=C/C5=CC=CC=C5
Metabolite of Species Details
Aspergillus hancockii (NCBI:txid1873369) See: PubMed
ChEBI Ontology
Outgoing Xenocockiamide C (CHEBI:221735) has functional parent cinnamic acid (CHEBI:27386)
Xenocockiamide C (CHEBI:221735) is a olefinic compound (CHEBI:78840)