(Q110193980)

English

(4S,4aS,7R,7aR)-4'-[(1R)-1-hydroxyethyl]-5'-oxospiro[3,4,4a,7a-tetrahydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylic acid

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

280.094688232 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₄H₁₆O₆

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canonical SMILES

O=C1OC2(C=CC3C(C(=O)O)COCC32)C=C1C(O)C

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isomeric SMILES

C[C@@H](O)C1=C[C@@]2(C=C[C@@H]3[C@H](C(=O)O)COC[C@@H]32)OC1=O

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found in taxon

Plumeria obtusa

1 reference

stated in

Isolation and characterization of secondary metabolites from Plumeria obtusa

Identifiers

InChI

InChI=1S/C14H16O6/c1-7(15)9-4-14(20-13(9)18)3-2-8-10(12(16)17)5-19-6-11(8)14/h2-4,7-8,10-11,15H,5-6H2,1H3,(H,16,17)/t7-,8-,10-,11+,14-/m1/s1

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InChIKey

PQYNIAIMRYNTQC-UDTSGEQISA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PQYNIAIMRYNTQC-UDTSGEQISA-N

(Q110193980)

(4S,4aS,7R,7aR)-4'-[(1R)-1-hydroxyethyl]-5'-oxospiro[3,4,4a,7a-tetrahydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylic acid

Statements

Identifiers

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