SpectraBase Compound ID | 8AKJu2GXOHC |
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InChI | InChI=1S/C49H36O27/c50-15-2-1-10(3-17(15)52)41-22(57)4-11-16(51)8-18(53)27(42(11)73-41)30-29-31-28(38(65)40(67)39(29)66)26-14(7-21(56)34(61)37(26)64)48(70)76-45(44(30)75-49(31)71)43-23(58)9-72-46(68)12-5-19(54)32(59)35(62)24(12)25-13(47(69)74-43)6-20(55)33(60)36(25)63/h1-3,5-8,22-23,30,41,43-45,50-67H,4,9H2/t22-,23+,30+,41+,43+,44+,45-/m1/s1 |
InChIKey | VFRPPNXPLILJQH-SESOJMRWSA-N |
Mol Weight | 1056.8 g/mol |
Molecular Formula | C49H36O27 |
Exact Mass | 1056.144396 g/mol |
SpectraBase Spectrum ID | L1O8to3BX88 |
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Name | STENOPHYLLANIN-C |
Compound Number | 9 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C49H36O27 |
InChI | InChI=1S/C49H36O27/c50-15-2-1-10(3-17(15)52)41-22(57)4-11-16(51)8-18(53)27(42(11)73-41)30-29-31-28(38(65)40(67)39(29)66)26-14(7-21(56)34(61)37(26)64)48(70)76-45(44(30)75-49(31)71)43-23(58)9-72-46(68)12-5-19(54)32(59)35(62)24(12)25-13(47(69)74-43)6-20(55)33(60)36(25)63/h1-3,5-8,22-23,30,41,43-45,50-67H,4,9H2/t22-,23+,30+,41+,43+,44+,45-/m1/s1 |
InChIKey | VFRPPNXPLILJQH-SESOJMRWSA-N |
Literature Reference Author | T.TANAKA,M.FUKUMORI,T.OCHI,I.KOUNO |
Literature Reference Citation | J.NAT.PROD.,66,759(2003) |
Literature Reference DOI | 10.1021/np020608g |
Molecular Weight | 1056.809 g/mol |
Solvent | ACETONE-D6:D2O |
Source File Reference | UWSI7837 |