Chem
J-GLOBAL ID:200907012705902664
Nikkaji number:J1.623.754J
(2S,3S,4R)-1-(α-D-Galactopyranosyloxy)-2-(pentacosanoylamino)-3,4-nonanediol
(2S,3S,4R)-1-(α-D-ガラクトピラノシルオキシ)-2-(ペンタコサノイルアミノ)-3,4-ノナンジオール
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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:
C40 H79 NO9
Molecular formula furigana:
C40-H79-N-O9
Molecular weight:
718.070
InChI:
InChI=1S/C40H79NO9/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27-29-35(44)41-32(36(45)33(43)28-26-6-4-2)31-49-40-39(48)38(47)37(46)34(30-42)50-40/h32-34,36-40,42-43,45-48H,3-31H2,1-2H3,(H,41,44)/t32-,33+,34+,36-,37-,38-,39+,40-/m0/s1
InChI key:
GJIILCQVXXLNJF-WVLAUNTOSA-N
SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCC
Systematic name (3):
(2S,3S,4R)-1-(α-D-ガラクトピラノシルオキシ)-2-(ペンタコサノイルアミノ)-3,4-ノナンジオール
N-[(2S,3S,4R)-3,4-ジヒドロキシ-1-{[(2S,3R,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}ノナン-2-イル]ペンタコサンアミド
N-[(2S,3S,4R)-3,4-dihydroxy-1-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}nonan-2-yl]pentacosanamide
Other name (1):
(2S,3S,4R)-1-(α-D-Galactopyranosyloxy)-2-(pentacosanoylamino)-3,4-nonanediol
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