(Q104990984)

English

(3R,4E,12E,20R,23E,27E)-hexatetraconta-4,12,23,27-tetraen-1,18,21,45-tetrayne-3,20-diol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(4E,12E,23E,27E)-hexatetraconta-4,12,23,27-tetraen-1,18,21,45-tetrayne-3,20-diol

1 reference

based on heuristic

inferred from SMILES

mass

654.53758148 dalton

1 reference

1 reference

C₄₆H₇₀O₂

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canonical SMILES

C#CCCCCCCCCCCCCCCCCC=CCCC=CC#CC(O)C#CCCCCC=CCCCCCCC=CC(O)C#C

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isomeric SMILES

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

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found in taxon

Petrosia ficiformis

1 reference

stated in

Further Petroformynes from Both Atlantic and Mediterranean Populations of the Sponge Petrosia ficiformis

Identifiers

InChI

InChI=1S/C46H70O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-28-31-34-37-40-43-46(48)44-41-38-35-32-29-26-23-22-24-27-30-33-36-39-42-45(47)4-2/h1-2,21,23,25-26,34,37,39,42,45-48H,5-20,22,24,27-33,35-36,38H2/b25-21+,26-23+,37-34+,42-39+/t45-,46-/m0/s1

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InChIKey

DXFHRHATAZATAU-QLRKLODKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DXFHRHATAZATAU-QLRKLODKSA-N

(Q104990984)

(3R,4E,12E,20R,23E,27E)-hexatetraconta-4,12,23,27-tetraen-1,18,21,45-tetrayne-3,20-diol

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Identifiers

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