CHEBI:211378 - Rakicidin I

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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 Rakicidin I
ChEBI ID CHEBI:211378
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C33H56N4O7
Net Charge 0
Average Mass 620.832
Monoisotopic Mass 620.41490
InChI InChI=1S/C33H56N4O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(2)30-25(4)32(42)35-24(3)20-21-27(39)37(5)22-26(38)36-28(33(43)44-30)29(40)31(34)41/h20-21,23,25,28-30,40H,3,6-19,22H2,1-2,4-5H3,(H2,34,41)(H,35,42)(H,36,38)/t23?,25-,28-,29?,30-/m0/s1
InChIKey NLGSLKQAXDHJJO-IUTSIRGWSA-N
SMILES O=C1N(CC(=O)N[C@H](C(=O)O[C@H]([C@@H](C(NC(C=C1)=C)=O)C)C(CCCCCCCCCCCCCCC)C)C(O)C(=O)N)C
Metabolite of Species Details
Micromonospora (NCBI:txid1873) See: DOI
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Rakicidin I (CHEBI:211378) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name
2-[(3S,14S,15S)-15-heptadecan-2-yl-7,14-dimethyl-11-methylidene-2,5,8,13-tetraoxo-1-oxa-4,7,12-triazacyclopentadec-9-en-3-yl]-2-hydroxyacetamide