Macrocarpal I
HIT214316020
sdf文件结构编辑类似物检索
HIT ID: HIT214316020
Cas No: 179388-54-6
分子式: C28H42O7
分子量: 490.637
常用名: Macrocarpal I
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-[(1R)-1-[(1S,4R,4aR,8aS)-4-hydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-decahydronaphthalen-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde
IUPAC: 5-[(1R)-1-[(1S,4R,4aR,8aS)-4-hydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-decahydronaphthalen-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde
SMILES: [H][C@]1(CC[C@@](C)(O)[C@]2([H])CC(CC[C@@]12C)C(C)(C)O)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |@:15|
SMILES: [H][C@]1(CC[C@@](C)(O)[C@]2([H])CC(CC[C@@]12C)C(C)(C)O)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |@:15|
InChI key: PXQFFMATXFLUPK-SVUALIIISA-N
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