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CHEBI:201624 - Stachartin E

ChEBI IDCHEBI:201624
ChEBI NameStachartin E
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FormulaC33H41NO6
Net Charge0
Average Mass547.692
Monoisotopic Mass547.29339
SMILESCOC(=O)C(Cc1ccccc1)N1Cc2c(cc(O)c3c2OC2(C3)C(C)CCC3C(C)(C)C(O)CCC32C)C1=O
InChIInChI=1S/C33H41NO6/c1-19-11-12-26-31(2,3)27(36)13-14-32(26,4)33(19)17-22-25(35)16-21-23(28(22)40-33)18-34(29(21)37)24(30(38)39-5)15-20-9-7-6-8-10-20/h6-10,16,19,24,26-27,35-36H,11-15,17-18H2,1-5H3
InChIKeyZWJSTYLVFXSIFD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Stachartin E (CHEBI:201624) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name 
methyl 2-[(3R,4aS,7R,8R,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrouro[2,3-e]isoindole]-7'-yl]-3-phenylpropanoate
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