Pulvomycin
HIT214317946
sdf文件结构编辑类似物检索
HIT ID: HIT214317946
Cas No: 11006-66-9
分子式: C47H66O13
分子量: 839.032
常用名: Pulvomycin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (4E,6R,7Z,9E,11E,14S,15E,17E,19E,22S)-22-[(2S,3S,4S,6E,8E,10E,12S,13S)-3,12-dihydroxy-13-{[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy}-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione
IUPAC: (4E,6R,7Z,9E,11E,14S,15E,17E,19E,22S)-22-[(2S,3S,4S,6E,8E,10E,12S,13S)-3,12-dihydroxy-13-{[(2R,3R,4S,5R,6R)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy}-4-methyl-5-oxotetradeca-6,8,10-trien-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione
SMILES: [H][C@]1(C\C=C\C=C\C=C\[C@H](O)C(=O)\C(C)=C\C=C\C(\C)=C/[C@@H](O)\C(C)=C\CC(=O)O1)[C@@H](C)[C@H](O)[C@H](C)C(=O)\C=C\C=C\C=C\[C@H](O)[C@H](C)O[C@@H]1O[C@H](C)[C@H](OC)[C@H](O)[C@H]1OC |c:19,t:3,5,7,14,16,24|
SMILES: [H][C@]1(C\C=C\C=C\C=C\[C@H](O)C(=O)\C(C)=C\C=C\C(\C)=C/[C@@H](O)\C(C)=C\CC(=O)O1)[C@@H](C)[C@H](O)[C@H](C)C(=O)\C=C\C=C\C=C\[C@H](O)[C@H](C)O[C@@H]1O[C@H](C)[C@H](OC)[C@H](O)[C@H]1OC |c:19,t:3,5,7,14,16,24|
InChI key: FXSFWUNCIOIMAC-JPZXWTFWSA-N
共显示1个结果
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