(Q104916160)

English

12a-hydroxymunduserone

group of stereoisomers with the chemical formula C₁₉H₁₈O₇

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Statements

instance of

group of stereoisomers

0 references

1 reference

358.10525291599987 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₉H₁₈O₇

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canonical SMILES

O=C1C2=CC=C(OC)C=C2OC3COC4=CC(OC)=C(OC)C=C4C13O

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Identifiers

InChI

InChI=1S/C19H18O7/c1-22-10-4-5-11-13(6-10)26-17-9-25-14-8-16(24-3)15(23-2)7-12(14)19(17,21)18(11)20/h4-8,17,21H,9H2,1-3H3

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InChIKey

APAWOEBSLLGWDF-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

APAWOEBSLLGWDF-UHFFFAOYSA-N

ChEBI ID

175596

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C19H18O7/c1-22-10-4-5-11-13(6-10)26-17-9-25-14-8-16(24-3)15(23-2)7-12(14)19(17,21)18(11)20/h4-8,17,21H,9H2,1-3H3

1 reference

Human Metabolome Database ID

HMDB0035070

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

APAWOEBSLLGWDF-UHFFFAOYSA-N

LIPID MAPS ID

LMPK12060051

1 reference

InChIKey

APAWOEBSLLGWDF-UHFFFAOYSA-N

17 April 2021

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

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