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CHEBI:42171 - 4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-8-METHYL-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER

Default Structure
ChEBI IDCHEBI:42171
ChEBI Name4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-8-METHYL-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
Stars
DownloadsMolfile
FormulaC22H19N3O4
Net Charge0
Average Mass389.411
Monoisotopic Mass389.13756
SMILES[H]Oc1c([H])c2c(c3c([H])c(C(=O)OC([H])([H])[H])n([H])c13)[C@]([H])(C([H])([H])[H])C([H])([H])N2C(=O)c1c([H])c2c([H])c([H])c([H])c([H])c2n1[H]
InChIInChI=1S/C22H19N3O4/c1-11-10-25(21(27)15-7-12-5-3-4-6-14(12)23-15)17-9-18(26)20-13(19(11)17)8-16(24-20)22(28)29-2/h3-9,11,23-24,26H,10H2,1-2H3/t11-/m1/s1
InChIKeySVXVQSGKGYZESS-LLVKDONJSA-N
ChEBI Ontology
Outgoing Relation(s)
4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-8-METHYL-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER (CHEBI:42171) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-8-METHYL-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTERPDBeChem
methyl (8S)-4-hydroxy-6-(1H-indol-2-ylcarbonyl)-8-methyl-3,6,7,8-tetrahydropyrrolo[3,2-e]indole-2-carboxylatePDBeChem
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