(Q105021518)

English

(1alpha,6alpha)-2alpha,7alpha,8beta,9beta-Tetrahydroxy-9-(hydroxymethyl)-3-oxabicyclo[4.3.0]nonane

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

iridoid

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mass

220.094688232 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₉H₁₆O₆

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canonical SMILES

OCC1(O)C(O)C(O)C2CCOC(O)C21

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isomeric SMILES

OC[C@]1(O)[C@H]2[C@H](O)OCC[C@H]2[C@H](O)[C@H]1O

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found in taxon

Crescentia alata

1 reference

stated in

Iridoids from Crescentia alata

Identifiers

InChI

InChI=1S/C9H16O6/c10-3-9(14)5-4(6(11)7(9)12)1-2-15-8(5)13/h4-8,10-14H,1-3H2/t4-,5-,6+,7-,8-,9+/m1/s1

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InChIKey

GVPJIARKBVSQGO-MWRHRVLASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GVPJIARKBVSQGO-MWRHRVLASA-N

1 reference

(Q105021518)

(1alpha,6alpha)-2alpha,7alpha,8beta,9beta-Tetrahydroxy-9-(hydroxymethyl)-3-oxabicyclo[4.3.0]nonane

Statements

Identifiers

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