(Q104970769)

English

CID 24094150

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-6-carbaldehyde

1 reference

based on heuristic

inferred from SMILES

mass

278.115423676 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,4S,11aR)-4-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carbaldehyde

1 reference

based on heuristic

inferred from InChIKey

(3aR,4S,6Z,10Z,11aR)-4-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carbaldehyde

1 reference

1 reference

(3aS,4S,6E,10E,11aS)-4-hydroxy-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carbaldehyde

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₁₈O₅

0 references

canonical SMILES

O=CC1=CCCC(=CC2OC(=O)C(=C)C2C(O)C1)CO

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isomeric SMILES

C=C1C(=O)O[C@@H]2/C=C(\CO)CC/C=C(/C=O)C[C@@H](O)[C@@H]12

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found in taxon

Lecocarpus pinnatifidus

1 reference

stated in

Melampolides from Lecocarpus pinnatifidus

Identifiers

InChI

InChI=1S/C15H18O5/c1-9-14-12(18)5-10(7-16)3-2-4-11(8-17)6-13(14)20-15(9)19/h3,6-7,12-14,17-18H,1-2,4-5,8H2/b10-3+,11-6-/t12-,13-,14-/m1/s1

0 references

InChIKey

CVISOHZWXIVDFN-SYHQWPJTSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

CVISOHZWXIVDFN-SYHQWPJTSA-N

1 reference

(Q104970769)

CID 24094150

Statements

Identifiers

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