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(Q83012776)
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English
(1,4,7,10,13,16)Hexaoxacyclooctadecino(2,3-f:11,12-f')bisbenzothiazole-2,14-diamine, 6,7,9,10,18,19,21,22-octahydro-
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
504.113726488
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₄N₄O₆S₂
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canonical SMILES
C1COC2=C(C=C3C(=C2)N=C(S3)N)OCCOCCOC4=C(C=C5C(=C4)N=C(S5)N)OCCO1
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Identifiers
InChI
InChI=1S/C22H24N4O6S2/c23-21-25-13-9-15-17(11-19(13)33-21)32-8-4-28-2-6-30-16-10-14-20(34-22(24)26-14)12-18(16)31-7-3-27-1-5-29-15/h9-12H,1-8H2,(H2,23,25)(H2,24,26)
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InChIKey
XZYSFYOWJFAIRH-UHFFFAOYSA-N
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CAS Registry Number
106000-45-7
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PubChem CID
60066
1 reference
matched by identifier from
InChIKey
InChIKey
XZYSFYOWJFAIRH-UHFFFAOYSA-N
UniChem compound ID
66526198
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80147462
1 reference
matched by identifier from
InChIKey
InChIKey
XZYSFYOWJFAIRH-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID6069953
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