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Asarinin
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
5-[(3aR,6R,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxole
1 reference
based on heuristic
inferred from SMILES
mass
354.1103382959999
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Episesamin
1 reference
based on heuristic
inferred from InChI
asarinin
1 reference
based on heuristic
inferred from InChI
Epiasarinin
1 reference
based on heuristic
inferred from InChI
(-)-sesamin
1 reference
based on heuristic
inferred from InChI
(+)-sesamin
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₁₈O₆
0 references
canonical SMILES
c1cc2c(cc1C1OCC3C(c4ccc5c(c4)OCO5)OCC13)OCO2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
c1cc2c(cc1[C@H]1OC[C@H]3[C@@H]1CO[C@H]3c1ccc3c(c1)OCO3)OCO2
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19-,20+/m0/s1
0 references
InChIKey
PEYUIKBAABKQKQ-WZBLMQSHSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
133-05-1
0 references
SureChEMBL ID
SCHEMBL976772
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PEYUIKBAABKQKQ-WZBLMQSHSA-N
DSSTox substance ID
DTXSID201033462
1 reference
matched by identifier from
InChIKey
InChIKey
PEYUIKBAABKQKQ-WZBLMQSHSA-N
UNII
F6PWY73ZGT
1 reference
matched by identifier from
InChIKey
InChIKey
PEYUIKBAABKQKQ-WZBLMQSHSA-N
C3RVX72NMG
1 reference
matched by identifier from
InChIKey
InChIKey
PEYUIKBAABKQKQ-WZBLMQSHSA-N
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