3-ISOMANGOSTIN HYDRATE FORMATE

CAS号
925705-36-8
CCD编号
CCD05427592
分子式
C25 H28 O8 . H2 O
分子量
474.503

基本信息

产品名称: 3-ISOMANGOSTIN HYDRATE FORMATE
CAS: 925705-36-8
英文同义词: 3-ISOMANGOSTIN HYDRATE FORMATE
MDL号: MFCD20260988
氢键受体数量: 8
氢键供体数量: 2
Smile: CC1(CCc2c(cc3c(c2O)c(=O)c4c(o3)cc(c(c4CCC(C)(C)OC=O)OC)O)O1)C.O
InChi: InChI=1S/C25H28O8.H2O/c1-24(2,31-12-26)8-7-14-19-17(10-15(27)23(14)30-5)32-18-11-16-13(6-9-25(3,4)33-16)21(28)20(18)22(19)29;/h10-12,27-28H,6-9H2,1-5H3;1H2
InChiKey: InChIKey=KQUSCBSXBQXBQP-UHFFFAOYSA-N

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