Name: Andrastin D
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219251705
Cas No:184432-08-4
常用名:Andrastin D
IUPAC:methyl (3aR,3bS,5aS,9aR,9bS,11aR)-1-hydroxy-2,3b,6,6,9a,11,11a-heptamethyl-3,7-dioxo-3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,11aH-cyclopenta[a]phenanthrene-3a-carboxylate
IUPAC:methyl (3aR,3bS,5aS,9aR,9bS,11aR)-1-hydroxy-2,3b,6,6,9a,11,11a-heptamethyl-3,7-dioxo-3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,11aH-cyclopenta[a]phenanthrene-3a-carboxylate
InChI key:SMUNNMAWNRFDPB-UWWAQUNASA-N

分子式:C26H36O5
分子量:428.569
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12CC[C@@]3(C)[C@@]([H])(C=C(C)[C@@]4(C)C(O)=C(C)C(=O)[C@@]34C(=O)OC)[C@]1(C)CCC(=O)C2(C)C
SMILES:[H][C@]12CC[C@@]3(C)[C@@]([H])(C=C(C)[C@@]4(C)C(O)=C(C)C(=O)[C@@]34C(=O)OC)[C@]1(C)CCC(=O)C2(C)C

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