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CHEBI:227025 - Curtachalasin L

ChEBI IDCHEBI:227025
ChEBI NameCurtachalasin L
Stars
Last Modified28 February 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H36ClNO6
Net Charge0
Average Mass542.072
Monoisotopic Mass541.22312
SMILESC=C1C(C)=C[C@@H]2[C@@H](Cl)[C@@H]3C[C@H](C)[C@@](O)(C(C)=O)[C@H](O)[C@H]3[C@@H](OC(C)=O)[C@]23C(=O)N[C@@H](Cc2ccccc2)[C@H]13
InChIInChI=1S/C30H36ClNO6/c1-14-11-21-25(31)20-12-15(2)30(37,17(4)33)26(35)23(20)27(38-18(5)34)29(21)24(16(14)3)22(32-28(29)36)13-19-9-7-6-8-10-19/h6-11,15,20-27,35,37H,3,12-13H2,1-2,4-5H3,(H,32,36)/t15-,20+,21+,22-,23-,24-,25-,26+,27+,29-,30+/m0/s1
InChIKeyGUSBEONINQEBMS-RVTILRPBSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (31408074)
ChEBI Ontology
Outgoing Relation(s)
Curtachalasin L (CHEBI:227025) is a organic heterotetracyclic compound (CHEBI:38163)
IUPAC Name 
[(1R,2R,3S,4R,5S,6S,8R,9S,10S,14R,15S)-5-acetyl-15-benzyl-9-chloro-4,5-dihydroxy-6,12-dimethyl-13-methylidene-17-oxo-16-azatetracyclo[8.7.0.01,14.03,8]heptadec-11-en-2-yl] acetate
Citations