(Q105304003)

English

(4aS,9bS)-9,9b-bis[(Z)-heptadec-10-enyl]-4a,8-dihydroxy-2,7-dimethoxydibenzofuran-1,4-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2,13-bis[(10Z)-heptadec-10-en-1-yl]-7,12-dihydroxy-4,11-dimethoxy-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),4,10,12-tetraene-3,6-dione

1 reference

based on heuristic

inferred from SMILES

9,9b-Bis(heptadec-10-enyl)-4a,8-dihydroxy-2,7-dimethoxydibenzofuran-1,4-dione

1 reference

based on heuristic

inferred from SMILES

mass

764.559104772 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₈H₇₆O₇

0 references

canonical SMILES

O=C1C=C(OC)C(=O)C2(C=3C(OC12O)=CC(OC)=C(O)C3CCCCCCCCCC=CCCCCCC)CCCCCCCCCC=CCCCCCC

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isomeric SMILES

CCCCCC/C=C\CCCCCCCCCc1c(O)c(OC)cc2c1[C@@]1(CCCCCCCCC/C=C\CCCCCC)C(=O)C(OC)=CC(=O)[C@@]1(O)O2

0 references

found in taxon

Iris pallasii

1 reference

stated in

Phenols and a dioxotetrahydrodibenzofuran from seeds of Iris pallasii

Identifiers

InChI

InChI=1S/C48H76O7/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-44-40(37-41(53-3)45(39)50)55-48(52)43(49)38-42(54-4)46(51)47(44,48)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h15-18,37-38,50,52H,5-14,19-36H2,1-4H3/b17-15-,18-16-/t47-,48+/m0/s1

0 references

InChIKey

WFLIDKCUUQSCIY-NBNRICOKSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105304003)

(4aS,9bS)-9,9b-bis[(Z)-heptadec-10-enyl]-4a,8-dihydroxy-2,7-dimethoxydibenzofuran-1,4-dione

Statements

Identifiers

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