| Name |
Anogeissusin B |
| Formula |
C97H62O57 |
| Mw |
2138.19528545 |
| CAS RN |
161161-62-2 |
| C_ID |
C00009344
, 
|
| InChIKey |
WIDDOALTJRLESQ-PXYYWATKNA-N |
| InChICode |
InChI=1S/C97H62O57/c98-19-9-20(99)36(81-13(19)3-28(107)80(148-81)12-1-21(100)54(108)22(101)2-12)47-44-52-42(70(124)78(132)72(44)126)40-50-38(66(120)75(129)68(40)122)34-17(7-26(105)58(112)63(34)117)90(136)147-30-11-145-93(139)49-37(35-18(8-27(106)59(113)64(35)118)92(138)150-83(30)86(153-96(50)142)84(47)151-94(52)140)65(119)77(131)73(127)45(49)48-46-53-43(71(125)79(133)74(46)128)41-51-39(67(121)76(130)69(41)123)33-16(6-25(104)57(111)62(33)116)89(135)146-29-10-144-88(134)14-4-23(102)55(109)60(114)31(14)32-15(5-24(103)56(110)61(32)115)91(137)149-82(29)87(154-97(51)143)85(48)152-95(53)141/h1-2,4-9,28-30,47-48,80,82-87,98-133H,3,10-11H2/t28-,29-,30-,47+,48+,80-,82-,83-,84+,85?,86+,87+/m1/s1 |
| SMILES |
O=C1O[C@H]2[C@@H](c3c(O)c(O)c(O)c4c3C(=O)OC[C@H]3OC(=O)c5cc(O)c(O)c(O)c5-c5c(O)c(O)c(O)c6c5C(=O)O[C@H]([C@H]5OC(=O)c7c(c(O)c(O)c(O)c7-6)[C@@H]5c5c(O)cc(O)c6c5O[C@H](c5cc(O)c(O)c(O)c5)[C@@H](O)C6)[C@@H]3OC(=O)c3cc(O)c(O)c(O)c3-4)c3c(O)c(O)c(O)c(c31)-c1c(O)c(O)c(O)c3c1C(=O)O[C@H]2[C@@H]1OC(=O)c2cc(O)c(O)c(O)c2-c2c(cc(O)c(O)c2O)C(=O)OC[C@H]1OC(=O)c1cc(O)c(O)c(O)c1-3 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Combretaceae | Anogeissus acuminata var. lanceolata | Ref. |
|
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