(Q105138656)

English

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2S,6R)-2,6,7-trihydroxy-7-methyl-3-methylideneoctoxy]oxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

2-(Hydroxymethyl)-6-(2,6,7-trihydroxy-7-methyl-3-methylideneoctoxy)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

366.18898254 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₆H₃₀O₉

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canonical SMILES

OCC1OC(OCC(O)C(=C)CCC(O)C(O)(C)C)C(O)C(O)C1O

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isomeric SMILES

C=C(CC[C@@H](O)C(C)(C)O)[C@H](O)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Glehnia littoralis

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stated in

Water-soluble constituents of Glehnia littoralis fruit

Identifiers

InChI

InChI=1S/C16H30O9/c1-8(4-5-11(19)16(2,3)23)9(18)7-24-15-14(22)13(21)12(20)10(6-17)25-15/h9-15,17-23H,1,4-7H2,2-3H3/t9-,10-,11-,12-,13+,14-,15-/m1/s1

0 references

InChIKey

KCAYCKZTNBMWEB-KXPQCWJOSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KCAYCKZTNBMWEB-KXPQCWJOSA-N

(Q105138656)

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2S,6R)-2,6,7-trihydroxy-7-methyl-3-methylideneoctoxy]oxane-3,4,5-triol

Statements

Identifiers

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