T-​2 Tetraol
HIT214315029
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HIT ID: HIT214315029
Cas No: 34114-99-3
分子式: C15H22O6
分子量: 298.335
常用名: T-​2 Tetraol
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2'R,4'S,7'R,9'R,10'R,11'S)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-ene-4',10',11'-triol
IUPAC: (2'R,4'S,7'R,9'R,10'R,11'S)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-ene-4',10',11'-triol
SMILES: [H][C@@]12O[C@]3([H])C=C(C)[C@@H](O)C[C@]3(CO)C(C)([C@H](O)[C@H]1O)C21CO1 |t:5,TLB:17:16:20:2.3.11,22:20:2.3.11:18.16,THB:12:11:20:18.16,10:11:20:18.16,19:18:20:2.3.11,21:20:2.3.11:18.16|
SMILES: [H][C@@]12O[C@]3([H])C=C(C)[C@@H](O)C[C@]3(CO)C(C)([C@H](O)[C@H]1O)C21CO1 |t:5,TLB:17:16:20:2.3.11,22:20:2.3.11:18.16,THB:12:11:20:18.16,10:11:20:18.16,19:18:20:2.3.11,21:20:2.3.11:18.16|
InChI key: ZAXZBJSXSOISTF-VREARNNESA-N
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