(Q76085162)

English

(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2R,3R,4S,5S,6R)-4-amino-6-(aminomethyl)-3,5-dihydroxyoxan-2-yl]oxy-2-hydroxycyclohexyl]oxyoxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

483.254042384 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₈H₃₇N₅O₁₀

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canonical SMILES

NCC1OC(OC2C(N)CC(N)C(OC3OC(CN)C(O)C(O)C3O)C2O)C(O)C(N)C1O

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)N)O)N

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Identifiers

InChI

InChI=1S/C18H37N5O10/c19-2-6-9(24)8(23)11(26)17(30-6)32-15-4(21)1-5(22)16(14(15)29)33-18-13(28)12(27)10(25)7(3-20)31-18/h4-18,24-29H,1-3,19-23H2/t4-,5+,6-,7-,8+,9-,10-,11-,12+,13-,14-,15+,16-,17-,18-/m1/s1

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InChIKey

UNAQVTHWZOBENA-NOAMYHISSA-N

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matched by identifier from

InChIKey

UNAQVTHWZOBENA-NOAMYHISSA-N

1 reference

1 reference

matched by identifier from

InChIKey

UNAQVTHWZOBENA-NOAMYHISSA-N

DSSTOX compound identifier

DTXCID901365907

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(Q76085162)

(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2R,3R,4S,5S,6R)-4-amino-6-(aminomethyl)-3,5-dihydroxyoxan-2-yl]oxy-2-hydroxycyclohexyl]oxyoxane-3,4,5-triol

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Identifiers

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