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CHEBI:200835 - Satratoxin H 13'-acetate

ChEBI IDCHEBI:200835
ChEBI NameSatratoxin H 13'-acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H38O10
Net Charge0
Average Mass570.635
Monoisotopic Mass570.24650
SMILESCC(=O)OC(C)C12C=C/C=C\C(=O)O[C@@H]3CC4OC5C=C(C)CC[C@]5(COC(=O)C=C(CCO1)[C@H]2O)[C@]3(C)[C@@]41CO1
InChIInChI=1S/C31H38O10/c1-18-8-11-29-16-36-26(34)14-21-9-12-37-30(27(21)35,19(2)39-20(3)32)10-6-5-7-25(33)41-22-15-24(40-23(29)13-18)31(17-38-31)28(22,29)4/h5-7,10,13-14,19,22-24,27,35H,8-9,11-12,15-17H2,1-4H3/b7-5-,10-6?,21-14?/t19?,22-,23?,24?,27-,28-,29-,30?,31-/m1/s1
InChIKeyKCAXSPYCWSZZBL-WENWRFNUSA-N
Species of MetaboliteComponentSourceComments
Podostroma (ncbitaxon:235375) - DOI (10.1016/s0040-4020(01)00824-9)
Roles Classification
Biological Role:
mycotoxin  Poisonous substance produced by fungi.
ChEBI Ontology
Outgoing Relation(s)
Satratoxin H 13'-acetate (CHEBI:200835) is a trichothecene (CHEBI:55517)
IUPAC Name 
1-[(6R,14R,15S,16R,19Z,27R)-27-hydroxy-9,15-dimethyl-3,18-dioxospiro[4,12,17,24-tetraoxapentacyclo[21.3.1.113,16.06,11.06,15]octacosa-1,9,19,21-tetraene-14,2'-oxirane]-23-yl]ethyl acetate