DELPHINIDINE-3-O-SAMBUBIOSIDE

pro_cas
pro_cdbregno
CCD00949033
pro_formula
C26H29ClO16
pro_molWeight
632.952

basic_info

Product_Name: DELPHINIDINE-3-O-SAMBUBIOSIDE
EnglishSynonyms: DELPHINIDINE-3-O-SAMBUBIOSIDE
pro_mdlNumber: MFCD10566840
pro_acceptors: 16
pro_donors: 11
pro_smile: [Cl-].OC[C@H]1O[C@@H](OC2=CC3=C(C=C(O)C=C3O)[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
InChi: InChI=1S/C26H28O16.ClH/c27-6-17-20(35)21(36)24(42-25-22(37)19(34)14(32)7-38-25)26(41-17)40-16-5-10-11(29)3-9(28)4-15(10)39-23(16)8-1-12(30)18(33)13(31)2-8;/h1-5,14,17,19-22,24-27,32,34-37H,6-7H2,(H4-,28,29,30,31,33);1H/t14-,17-,19+,20-,21+,22-,24-,25+,26-;/m1./s1
InChiKey: InChIKey=BNDHUCYNCNEUSY-CPXTURKASA-N

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