(Q105218803)

English

melilotocarpan B

group of stereoisomers with the chemical formula C₁₆H₁₄O₅

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Statements

instance of

group of stereoisomers

0 references

1 reference

286.084123548 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₆H₁₄O₅

0 references

canonical SMILES

OC1=CC=C2C(OC3C4=CC=C(OC)C(O)=C4OCC23)=C1

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found in taxon

Melilotus messanensis

1 reference

stated in

Studies on the pterocarpans from Melilotus alba Desr.

Melilotus siculus

1 reference

stated in

Studies on the pterocarpans from Melilotus alba Desr.

Identifiers

InChI

InChI=1S/C16H14O5/c1-19-12-5-4-10-15-11(7-20-16(10)14(12)18)9-3-2-8(17)6-13(9)21-15/h2-6,11,15,17-18H,7H2,1H3

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InChIKey

QDFJNOVWEADTGJ-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QDFJNOVWEADTGJ-UHFFFAOYSA-N

ChEBI ID

172519

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C16H14O5/c1-19-12-5-4-10-15-11(7-20-16(10)14(12)18)9-3-2-8(17)6-13(9)21-15/h2-6,11,15,17-18H,7H2,1H3

1 reference

Human Metabolome Database ID

HMDB0029527

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

QDFJNOVWEADTGJ-UHFFFAOYSA-N

LIPID MAPS ID

LMPK12070077

1 reference

InChIKey

QDFJNOVWEADTGJ-UHFFFAOYSA-N

17 April 2021

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

(Q105218803)

melilotocarpan B

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Identifiers

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