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基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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.; NSC 101088; NSC 273757; Withaferine; Withaferine A; (4ss,5ss,6ss,22R)-5,6-Epoxy-4,22,27-trihydroxy CAS 5119-48-2 PubChem CID 265237
CC1=C(CO)C(=O)O[C@@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@H]5O[C@]56[C@@H](O)C=CC(=O)[C@]6(C)[C@H]4CC[C@]23C)C1 -
5ss-ergosta-2,24-dien-26-oic Acid d-Lactone; Deuterated NSC 101088; Deuterated NSC 273757; Deuterated Withaferine PubChem CID 171381286
[2H]C([2H])([2H])C1=C(CO)C(=O)O[C@@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@H]5O[C@]56[C@@H](O)C=CC(=O)[C@]6(C)[C@H]4CC[C@]23C)C1 -
SCHEMBL23924331 PubChem CID 21199
CC1=C(C[C@@H](O)[C@H](C)C2CCC3C4C[C@H]5O[C@]56[C@@H](O)C=CC(=O)C6(C)C4CCC32C)COC1=O -
4-Hydroxy-9-(1-[5-(hydroxymethyl)-4-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl)-9a,11b-dimethyl-5a,6,6a,6b,7,8,9,9a,10,11,11a,11b-dodecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-1(4H)-one # CAS 5119-48-2 PubChem CID 580064
CC1=C(CO)C(=O)OC(C(C)C2CCC3C4CC5OC56C(O)C=CC(=O)C6(C)C4CCC23C)C1 -
2,3,3-trimethyl-2H-benzo[g]benzofuran-4,5-dione PubChem CID 118701146
CC1=C(CO)C(=O)OC([C@@H](C)[C@H]2CC[C@H]3C4C[C@H]5O[C@]56[C@@H](O)C=CC(=O)[C@]6(C)[C@H]4CC[C@]23C)C1