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(Q82996001)
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English
1,4-Butanediol, 2,3-bis(1,3-benzodioxol-5-ylmethyl)-, diacetate, (2R,3R)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
442.162767792
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₂₆O₈
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canonical SMILES
O=C(OCC(CC1=CC=C2OCOC2=C1)C(COC(=O)C)CC3=CC=C4OCOC4=C3)C
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isomeric SMILES
CC(=O)OC[C@H](CC1=CC2=C(C=C1)OCO2)[C@@H](CC3=CC4=C(C=C3)OCO4)COC(=O)C
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found in taxon
Bursera microphylla
1 reference
stated in
Diterpenoids and Triterpenoids from the Resin of Bursera microphylla and Their Cytotoxic Activity
Identifiers
InChI
InChI=1S/C24H26O8/c1-15(25)27-11-19(7-17-3-5-21-23(9-17)31-13-29-21)20(12-28-16(2)26)8-18-4-6-22-24(10-18)32-14-30-22/h3-6,9-10,19-20H,7-8,11-14H2,1-2H3/t19-,20-/m0/s1
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InChIKey
GFOPJZZAXNTRGJ-PMACEKPBSA-N
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CAS Registry Number
81410-43-7
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PubChem CID
5488712
1 reference
matched by identifier from
InChIKey
InChIKey
GFOPJZZAXNTRGJ-PMACEKPBSA-N
UniChem compound ID
32431263
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001001974
1 reference
matched by identifier from
InChIKey
InChIKey
GFOPJZZAXNTRGJ-PMACEKPBSA-N
DSSTOX compound identifier
DTXCID901428913
0 references
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