CHEBI:200409 - Cinnabaramide F

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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 Cinnabaramide F
ChEBI ID CHEBI:200409
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H38N2O7S
Net Charge 0
Average Mass 498.640
Monoisotopic Mass 498.23997
InChI InChI=1S/C24H38N2O7S/c1-4-5-6-10-13-17-20(29)26-24(23(17,3)33,19(28)16-11-8-7-9-12-16)22(32)34-14-18(21(30)31)25-15(2)27/h8,11,16-19,28,33H,4-7,9-10,12-14H2,1-3H3,(H,25,27)(H,26,29)(H,30,31)/t16-,17+,18+,19+,23+,24+/m1/s1
InChIKey LNANRAACAKDGBI-HIOGCZMJSA-N
SMILES S(C(=O)[C@@]1(NC(=O)[C@@H]([C@@]1(O)C)CCCCCC)[C@@H](O)[C@@H]2C=CCCC2)C[C@H](NC(=O)C)C(=O)O
Metabolite of Species Details
Streptomycesspecies (NCBI:txid1931) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Cinnabaramide F (CHEBI:200409) is a N-acyl-L-amino acid (CHEBI:21644)
IUPAC Name
(2R)-2-acetamido-3-[(2R,3S,4R)-2-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-4-hexyl-3-hydroxy-3-methyl-5-oxopyrrolidine-2-carbonyl]sulanylpropanoic acid
Manual Xref Database
17267199 ChemSpider
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