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[1-13Cglc]乳糖一水合物 | 287100-62-3

[1-13Cglc]乳糖一水合物结构式图片|287100-62-3结构式图片
[1-13Cglc]乳糖一水合物
1-13CglcLactose Monohydrate
287100-62-3
C12H22O11.H2O
360.31176
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:[1-13Cglc]乳糖一水合物结构式
522113
名称和标识符
InChIKey WSVLPVUVIUVCRA-FKZVOWNZSA-N
Inchi InChI=1S/C12H22O11.H2O/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17;/h3-20H,1-2H2;1H2/t3-,4-,5+,6+,7-,8-,9-,10-,11?,12+;/m1./s1/i11+1;
SMILES O.OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[13CH](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
别名信息
- 中文别名 -
  • [1-13CGlc]乳糖单水合物
  • [1-13Cglc]乳糖一水合物
- 英文别名 -
  • a-D-Glucopyranose-1-13C, 4-O-b-D-galactopyranosyl-, monohydrate(9CI)
  • [1-13Cglc]Lactose Monohydrate
  • 4-O-β-D-GALACTOPYRANOSYL-D-[1-13C]GLUCOSE
  • 64044-51-5
  • F8881-6795
  • alpha-D-Glucopyranose, 4-O-beta-D-galactopyranosyl-, monohydrate
  • alpha-D-Glucopyranose, 4-O-beta-D-galactopyranosyl-, monohydrate
  • .alpha.-D-Glucopyranose, 4-O-.beta.-D-galactopyranosyl-, monohydrate
  • .alpha.-D-Glucopyranose, 4-O-.beta.-D-galactopyranosyl-, monohydrate
  • 4-O-BETA-D-GALACTOPYRANOSYL-D-[1-13C]GLUCOSE
  • 4-O-BETA-D-GALACTOPYRANOSYL-D-[1-13C]GLUCOSE
  • Pharmatose 200M
  • Pharmatose 450M
  • Pharmatose 200M
  • Pharmatose 450M
  • SCHEMBL19582547
  • SCHEMBL19582547
  • Pharmatose DCL 14
  • Pharmatose DCL 14
  • FT-0622146
  • FT-0622146
  • 287100-62-3
  • 287100-62-3
  • 2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol
  • hydrate
  • 2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol
  • hydrate
  • (2R,3R,4S,5R,6S)-2-(Hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol
  • hydrate
  • (2R,3R,4S,5R,6S)-2-(Hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol
  • hydrate
  • .alpha.-d-Lactose
  • .alpha.-d-Lactose
  • 2-(Hydroxymethyl)-6-{[4,5,6-trihydroxy-2-(hydroxy-methyl)oxan-3-yl]oxy}oxane-3,4,5-triol hydrate
  • 2-(Hydroxymethyl)-6-{[4,5,6-trihydroxy-2-(hydroxy-methyl)oxan-3-yl]oxy}oxane-3,4,5-triol hydrate
  • FT-0625412
  • FT-0625412
  • MALTOSEMONOHYDRATE
  • MALTOSEMONOHYDRATE
  • 2-(hydroxymethyl)-6-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol hydrate
  • D-Lactose monohydrate
  • 2-(hydroxymethyl)-6-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol hydrate
  • AKOS026676751
  • D-Lactose monohydrate
  • 10039-26-6
  • AKOS026676751
  • 10039-26-6
物化性质
实验特性
LogP -5.46150
PSA 198.76000
计算特性
精确分子量 361.13000
氢键供体数量 9
氢键受体数量 12
可旋转化学键数量 4
同位素质量 360.12677620g/mol
重原子数量 24
复杂度 382
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 10
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 2
拓扑分子极性表面积 191Ų
专业数据库参考
PubChemId 522113
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