SpectraBase Compound ID | AeDaAAVKt6J |
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InChI | InChI=1S/C75H56O48/c76-27-1-18(2-28(77)46(27)90)65(103)118-61-55(99)42(115-74(122-69(107)22-9-35(84)50(94)36(85)10-22)63(61)120-67(105)20-5-31(80)48(92)32(81)6-20)16-112-72(110)26-14-40(89)53(97)58(102)59(26)114-41-15-25-45(57(101)54(41)98)44-24(13-39(88)52(96)56(44)100)71(109)113-17-43-60(117-73(25)111)62(119-66(104)19-3-29(78)47(91)30(79)4-19)64(121-68(106)21-7-33(82)49(93)34(83)8-21)75(116-43)123-70(108)23-11-37(86)51(95)38(87)12-23/h1-15,42-43,55,60-64,74-102H,16-17H2/t42-,43-,55-,60-,61+,62+,63-,64-,74+,75+/m1/s1 |
InChIKey | XRQQBDLTEVWBIZ-GBDOURBHSA-N |
Mol Weight | 1725.2 g/mol |
Molecular Formula | C75H56O48 |
Exact Mass | 1724.194104 g/mol |
SpectraBase Spectrum ID | 422YJBzVcmH |
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Name | CORNUSIIN_G |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C75H56O48 |
InChI | InChI=1S/C75H56O48/c76-27-1-18(2-28(77)46(27)90)65(103)118-61-55(99)42(115-74(122-69(107)22-9-35(84)50(94)36(85)10-22)63(61)120-67(105)20-5-31(80)48(92)32(81)6-20)16-112-72(110)26-14-40(89)53(97)58(102)59(26)114-41-15-25-45(57(101)54(41)98)44-24(13-39(88)52(96)56(44)100)71(109)113-17-43-60(117-73(25)111)62(119-66(104)19-3-29(78)47(91)30(79)4-19)64(121-68(106)21-7-33(82)49(93)34(83)8-21)75(116-43)123-70(108)23-11-37(86)51(95)38(87)12-23/h1-15,42-43,55,60-64,74-102H,16-17H2/t42-,43-,55-,60-,61+,62+,63-,64-,74+,75+/m1/s1 |
InChIKey | XRQQBDLTEVWBIZ-GBDOURBHSA-N |
Literature Reference Author | T.HATANO,T.YASUHARA,R.ABE,T.OKUDA |
Literature Reference Citation | PHYTOCHEM.,29,2975(1990) |
Literature Reference DOI | 10.1016/0031-9422(90)87118-E |
Molecular Weight | 1725.241 g/mol |
Solvent | ACETONE-D6:D2 |
Source File Reference | UWMZ17711 |