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CHEBI:210983 - Leporizine C

ChEBI IDCHEBI:210983
ChEBI NameLeporizine C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H31N3O8S2
Net Charge0
Average Mass589.692
Monoisotopic Mass589.15526
SMILESCS[C@]12C(=O)N3[C@H]4Nc5ccccc5C4(O)[C@@H](O)[C@@]3(SC)C(=O)N1C1CC3=C(C(=O)C1(O)[C@H]2O)C(C)(C)[C@H](C)O3
InChIInChI=1S/C27H31N3O8S2/c1-11-23(2,3)16-14(38-11)10-15-25(37,17(16)31)19(33)26(39-4)22(35)30-20-24(36,12-8-6-7-9-13(12)28-20)18(32)27(30,40-5)21(34)29(15)26/h6-9,11,15,18-20,28,32-33,36-37H,10H2,1-5H3/t11-,15?,18+,19+,20+,24?,25?,26+,27+/m0/s1
InChIKeyUVKZABJPNZLAII-GJLGOLQDSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - PubMed (24050204)
ChEBI Ontology
Outgoing Relation(s)
Leporizine C (CHEBI:210983) is a pyrroloindole (CHEBI:48133)
IUPAC Name 
(1R,8S,13R,14R,17R,26R)-12,13,25,26-tetrahydroxy-8,9,9-trimethyl-1,14-bis(methylsulanyl)-7-oxa-3,16,18-triazaheptacyclo[14.10.0.03,14.04,12.06,10.017,25.019,24]hexacosa-6(10),19,21,23-tetraene-2,11,15-trione
Manual XrefsDatabases
29784939ChemSpider