Chem
J-GLOBAL ID:200907039537736910   Nikkaji number:J2.312.034H

1,1′-[3,6-Dioxaoctane-1,8-diylbis(octadecylimino)]bis(1-deoxy-D-glucitol)

1,1′-[3,6-ジオキサオクタン-1,8-ジイルビス(オクタデシルイミノ)]ビス(1-デオキシ-D-グルシトール)
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C54H112N2O12
Molecular formula furigana: C54-H112-N2-O12
Molecular weight: 981.492
InChI: InChI=1S/C54H112N2O12/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-55(43-47(59)51(63)53(65)49(61)45-57)37-39-67-41-42-68-40-38-56(44-48(60)52(64)54(66)50(62)46-58)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h47-54,57-66H,3-46H2,1-2H3/t47-,48-,49+,50+,51+,52+,53+,54+/m0/s1
InChI key: HHKHUHKCYULRGK-GEWIHHFASA-N
SMILES: CCCCCCCCCCCCCCCCCCN(CCOCCOCCN(CCCCCCCCCCCCCCCCCC)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
Systematic name  (3):
  • 1,1′-[3,6-ジオキサオクタン-1,8-ジイルビス(オクタデシルイミノ)]ビス(1-デオキシ-D-グルシトール)
  • (2R,3R,4R,5S,18S,19R,20R,21R)-7,16-ジオクタデシル-10,13-ジオキサ-7,16-ジアザドコサン-1,2,3,4,5,18,19,20,21,22-デカオール
  • (2R,3R,4R,5S,18S,19R,20R,21R)-7,16-dioctadecyl-10,13-dioxa-7,16-diazadocosane-1,2,3,4,5,18,19,20,21,22-decol
Other name (1):
  • 1,1′-[3,6-Dioxaoctane-1,8-diylbis(octadecylimino)]bis(1-deoxy-D-glucitol)
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