Neopanaxadiol
HIT214322302
sdf文件结构编辑类似物检索
HIT ID: HIT214322302
Cas No: 1203590-03-7
分子式: C30H52O3
分子量: 460.743
常用名: Neopanaxadiol
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1S,3aR,3bR,5aR,7S,9aR,9bR,11R,11aR)-1-[(2E)-6-hydroxy-6-methylhept-2-en-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-7,11-diol
IUPAC: (1S,3aR,3bR,5aR,7S,9aR,9bR,11R,11aR)-1-[(2E)-6-hydroxy-6-methylhept-2-en-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-7,11-diol
SMILES: [H][C@@]12[C@H](CC[C@@]1(C)[C@]1(C)CC[C@@]3([H])C(C)(C)[C@@H](O)CC[C@]3(C)[C@@]1([H])C[C@H]2O)C(\C)=C\CCC(C)(C)O
SMILES: [H][C@@]12[C@H](CC[C@@]1(C)[C@]1(C)CC[C@@]3([H])C(C)(C)[C@@H](O)CC[C@]3(C)[C@@]1([H])C[C@H]2O)C(\C)=C\CCC(C)(C)O
InChI key: CZMPRYZUTNMZPT-XFDQNDEISA-N
共显示1个结果
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TargetMol
SC
10600 购物车
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