Chem
J-GLOBAL ID:200907001830536260
Nikkaji number:J2.561.986B
Rhizochalin C
リゾカリンC
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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:
C34 H68 N2 O9
Molecular formula furigana:
C34-H68-N2-O9
Molecular weight:
648.923
InChI:
InChI=1S/C34H68N2O9/c1-25(35)28(40)21-17-13-10-12-16-20-26(39)19-15-11-8-6-4-2-3-5-7-9-14-18-22-29(27(36)23-37)44-34-33(43)32(42)31(41)30(24-38)45-34/h25,27-34,37-38,40-43H,2-24,35-36H2,1H3/t25-,27-,28-,29-,30-,31+,32+,33-,34-/m1/s1
InChI key:
LTQNHMJORFUEBP-PEYGHRBVSA-N
SMILES:
C[C@@H](N)[C@H](O)CCCCCCCC(=O)CCCCCCCCCCCCCC[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](N)CO
Systematic name (3):
(2R,3R,26R,27R)-2,27-ジアミノ-1,26-ジヒドロキシ-3-(β-D-ガラクトピラノシルオキシ)オクタコサン-18-オン
(2R,3R,26R,27R)-2,27-ジアミノ-3,28-ジヒドロキシ-26-{[(2R,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}オクタコサン-11-オン
(2R,3R,26R,27R)-2,27-diamino-3,28-dihydroxy-26-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octacosan-11-one
Other name (3):
(2R,3R,26R,27R)-2,27-Diamino-1,26-dihydroxy-3-(β-D-galactopyranosyloxy)octacosane-18-one
リゾカリンC
Rhizochalin C
Thsaurus map:
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