(Q105342264)

English

(2R,5S,6R)-5-{[(5S,6R)-5-{[(2R,3R,6R)-3,4-dihydroxy-6-methyl-5-{[(4R)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-(hydroxymethyl)oxane-2,3,4-triol

group of stereoisomers with the chemical formula C₂₅H₄₃NO₁₈

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

645.2480135359999 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₅H₄₃NO₁₈

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canonical SMILES

OCC1=CC(NC2C(O)C(O)C(OC2C)OC3C(O)C(O)C(OC3CO)OC4C(O)C(O)C(O)OC4CO)C(O)C(O)C1O

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isomeric SMILES

C[C@H]1O[C@H](O[C@H]2C(O)C(O)C(O[C@H]3C(O)C(O)[C@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)C(O)C1NC1C=C(CO)[C@@H](O)C(O)C1O

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Identifiers

InChI

InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8?,9-,10-,11?,12-,13?,14?,15?,16?,17?,18?,19-,20?,21-,22-,23-,24-,25?/m1/s1

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InChIKey

XUFXOAAUWZOOIT-YCBOVGQPSA-N

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PubChem CID

134694648

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matched by identifier from

InChIKey

XUFXOAAUWZOOIT-YCBOVGQPSA-N

(Q105342264)

(2R,5S,6R)-5-{[(5S,6R)-5-{[(2R,3R,6R)-3,4-dihydroxy-6-methyl-5-{[(4R)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-(hydroxymethyl)oxane-2,3,4-triol

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Identifiers

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