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CHEBI:45342 - (1R,3A'S,10'S,10A'R)-7-METHOXY-2-OXO-10',10A'-DIHYDRO-2H,3A'H-SPIRO[NAPHTHALENE-1,3'-PENTALENO[1,2-B]NAPHTHALEN]-10'-YL 2,6-DIDEOXY-2-(METHYLAMINO)-ALPHA-D-GALACTOPYRANOSIDE

Default Structure
ChEBI IDCHEBI:45342
ChEBI Name(1R,3A'S,10'S,10A'R)-7-METHOXY-2-OXO-10',10A'-DIHYDRO-2H,3A'H-SPIRO[NAPHTHALENE-1,3'-PENTALENO[1,2-B]NAPHTHALEN]-10'-YL 2,6-DIDEOXY-2-(METHYLAMINO)-ALPHA-D-GALACTOPYRANOSIDE
Stars
Last Modified2 December 2009
DownloadsMolfile
FormulaC33H33NO6
Net Charge0
Average Mass539.628
Monoisotopic Mass539.23079
SMILES[H]O[C@@]1([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])[H])O[C@]([H])(O[C@]2([H])c3c(c([H])c4c([H])c([H])c([H])c([H])c4c3[H])[C@@]3([H])[C@]4(C(=O)C([H])=C([H])c5c([H])c([H])c(OC([H])([H])[H])c([H])c54)C([H])=C([H])[C@]32[H])[C@]1([H])N([H])C([H])([H])[H]
InChIInChI=1S/C33H33NO6/c1-17-29(36)30(37)28(34-2)32(39-17)40-31-22-12-13-33(25-16-21(38-3)10-8-18(25)9-11-26(33)35)27(22)23-14-19-6-4-5-7-20(19)15-24(23)31/h4-17,22,27-32,34,36-37H,1-3H3/t17-,22-,27+,28-,29+,30-,31+,32-,33-/m1/s1
InChIKeyJDIJVHOCLRRXFM-ILPMIGAWSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,3A'S,10'S,10A'R)-7-METHOXY-2-OXO-10',10A'-DIHYDRO-2H,3A'H-SPIRO[NAPHTHALENE-1,3'-PENTALENO[1,2-B]NAPHTHALEN]-10'-YL 2,6-DIDEOXY-2-(METHYLAMINO)-ALPHA-D-GALACTOPYRANOSIDE (CHEBI:45342) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(1R,3a'S,10'S,10a'R)-7-methoxy-2-oxo-10',10a'-dihydro-2H,3a'H-spiro[naphthalene-1,3'-pentaleno[1,2-b]naphthalen]-10'-yl 2,6-dideoxy-2-(methylamino)-alpha-D-galactopyranosidePDBeChem
(1R,3A'S,10'S,10A'R)-7-METHOXY-2-OXO-10',10A'-DIHYDRO-2H,3A'H-SPIRO[NAPHTHALENE-1,3'-PENTALENO[1,2-B]NAPHTHALEN]-10'-YL 2,6-DIDEOXY-2-(METHYLAMINO)-ALPHA-D-GALACTOPYRANOSIDEPDBeChem
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