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CHEBI:46094 - 6-(OCTAHYDRO-1H-INDOL-1-YLMETHYL)DECAHYDROQUINAZOLINE-2,4-DIAMINE

Default Structure
ChEBI IDCHEBI:46094
ChEBI Name6-(OCTAHYDRO-1H-INDOL-1-YLMETHYL)DECAHYDROQUINAZOLINE-2,4-DIAMINE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC17H33N5
Net Charge0
Average Mass307.486
Monoisotopic Mass307.27360
SMILES[H]N([H])[C@@]1([H])N([H])[C@@]([H])(N([H])[H])[C@]2([H])C([H])([H])[C@@]([H])(C([H])([H])N3C([H])([H])C([H])([H])[C@@]4([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@]34[H])C([H])([H])C([H])([H])[C@]2([H])N1[H]
InChIInChI=1S/C17H33N5/c18-16-13-9-11(5-6-14(13)20-17(19)21-16)10-22-8-7-12-3-1-2-4-15(12)22/h11-17,20-21H,1-10,18-19H2/t11-,12+,13+,14-,15-,16+,17+/m0/s1
InChIKeyHDQIGGQUKAQTGU-SZTTVXCBSA-N
ChEBI Ontology
Outgoing Relation(s)
6-(OCTAHYDRO-1H-INDOL-1-YLMETHYL)DECAHYDROQUINAZOLINE-2,4-DIAMINE (CHEBI:46094) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(2R,4R,4aR,6S,8aS)-6-[(3aR,7aS)-octahydro-1H-indol-1-ylmethyl]decahydroquinazoline-2,4-diaminePDBeChem
6-(OCTAHYDRO-1H-INDOL-1-YLMETHYL)DECAHYDROQUINAZOLINE-2,4-DIAMINEPDBeChem
Manual XrefsDatabases
TQTPDBeChem