(Q105282064)

English

(8E,10E,12S)-heptadeca-8,10-dien-4,6-diyne-1,12-diol

chemical compound

In more languages

Statements

type of chemical entity

0 references

(8E,10E)-heptadeca-8,10-dien-4,6-diyne-1,12-diol

1 reference

based on heuristic

inferred from SMILES

heptadeca-8,10-dien-4,6-diyne-1,12-diol

1 reference

based on heuristic

inferred from SMILES

260.177630008 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(8E,10E,12R)-heptadeca-8,10-dien-4,6-diyne-1,12-diol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₄O₂

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canonical SMILES

OCCCC#CC#CC=CC=CC(O)CCCCC

0 references

isomeric SMILES

CCCCC[C@H](O)/C=C/C=C/C#CC#CCCCO

0 references

3 references

Absolute stereochemistry of cicutoxin and related toxic polyacetylenic alcohols from Cicuta virosa

Exploring the structural basis of neurotoxicity in C(17)-polyacetylenes isolated from water hemlock

Absolute stereochemistry of cicutoxin and related toxic polyacetylenic alcohols from Cicuta virosa

Identifiers

InChI=1S/C17H24O2/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18/h7,9,12,15,17-19H,2-3,10-11,13-14,16H2,1H3/b9-7+,15-12+/t17-/m0/s1

0 references

UYZBGAFJAALREV-WHLLTAFYSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C17H24O2/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18/h7,9,12,15,17-19H,2-3,10-11,13-14,16H2,1H3/b9-7+,15-12+/t17-/m0/s1

UniChem compound ID

1 reference

1 reference

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

15 January 2022

UYZBGAFJAALREV-WHLLTAFYSA-N

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