Cas no 704206-76-8 (Frondecaside)

Frondecaside structure
Frondecaside structure
Product Name:Frondecaside
CAS No:704206-76-8
MF:C58H98O63S6
MW:1995.75093889236
CID:6761795
Update Time:2024-03-03

Frondecaside Chemical and Physical Properties

Names and Identifiers

    • Frondecaside
    • Inchi: 1S/C58H98O63S6/c1-13-39(111-53-37(75)43(27(65)19(109-53)11-103-124(83,84)85)113-51-35(73)41(95-3)25(63)17(107-51)9-101-122(77,78)79)33(71)47(115-49-31(69)23(61)15(59)5-97-49)57(105-13)117-45-29(67)21(120-126(89,90)91)7-99-55(45)119-56-46(30(68)22(8-100-56)121-127(92,93)94)118-58-48(116-50-32(70)24(62)16(60)6-98-50)34(72)40(14(2)106-58)112-54-38(76)44(28(66)20(110-54)12-104-125(86,87)88)114-52-36(74)42(96-4)26(64)18(108-52)10-102-123(80,81)82/h13-76H,5-12H2,1-4H3,(H,77,78,79)(H,80,81,82)(H,83,84,85)(H,86,87,88)(H,89,90,91)(H,92,93,94)
    • InChI Key: KJWYRJIUGYNCOB-UHFFFAOYSA-N
    • SMILES: COC1C(O)C(OC2C(O)C(OC3C(O)C(OC4C(O)C(O)C(O)CO4)C(OC4C(OC5C(OC6C(OC7C(O)C(O)C(O)CO7)C(O)C(OC7C(O)C(OC8C(O)C(OC)C(O)C(COS(=O)(=O)O)O8)C(O)C(COS(=O)(=O)O)O7)C(C)O6)C(O)C(OS(=O)(=O)O)CO5)OCC(OS(=O)(=O)O)C4O)OC3C)OC(COS(=O)(=O)O)C2O)OC(COS(=O)(=O)O)C1O
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