Name: Yadanziolide C
Rating: 5 (10 reviews)

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sdf 文件

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HIT ID:HIT212665991
Cas No:95258-12-1
常用名:Yadanziolide C
别名:鸦胆苦内酯C
IUPAC:(1R,2R,3R,6R,8S,12R,13S,14R,15R,16S,17R)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.0^{1,6}.0^{2,17}.0^{8,13}]nonadec-9-ene-4,11-dione
IUPAC:(1R,2R,3R,6R,8S,12R,13S,14R,15R,16S,17R)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.0^{1,6}.0^{2,17}.0^{8,13}]nonadec-9-ene-4,11-dione
InChI key:JBDMZGKDLMGOFR-CABQPPGUSA-N

分子式:C20H26O9
分子量:410.419
氢键供体数 (HBD):5
氢键受体数 (HBA):8
LogP:-2.2455788
SMILES:[H][C@@]12C[C@@]3([H])C(C)=CC(=O)[C@H](O)[C@]3(C)[C@@]3([H])[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]13[C@@]4(O)[C@@H](O)C(=O)O2 |c:6|
SMILES:[H][C@@]12C[C@@]3([H])C(C)=CC(=O)[C@H](O)[C@]3(C)[C@@]3([H])[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]13[C@@]4(O)[C@@H](O)C(=O)O2 |c:6|

Yadanziolide C induces differentiation with cultured HL-60 promyelocytic leukemia cells.

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