| Name |
Woodfordin D |
| Formula |
C109H76O70 |
| Mw |
2504.23872599 |
| CAS RN |
137422-97-0 |
| C_ID |
C00035429
, 
|
| InChIKey |
WBSYRVANNCZWSX-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C109H76O70/c110-18-55(91(174-96(150)23-1-36(112)64(128)37(113)2-23)89-50(126)20-163-100(154)27-9-44(120)68(132)77(141)58(27)59-28(103(157)172-89)10-45(121)69(133)78(59)142)169-106(160)33-12-47(123)71(135)83(147)86(33)166-52-15-30-62(81(145)75(52)139)63-32-17-54(76(140)82(63)146)168-88-35(14-49(125)73(137)85(88)149)108(162)178-95-94(177-98(152)25-5-40(116)66(130)41(117)6-25)93-57(171-109(95)179-99(153)26-7-42(118)67(131)43(119)8-26)22-165-102(156)31-16-53(74(138)80(144)61(31)60-29(104(158)176-93)11-46(122)70(134)79(60)143)167-87-34(13-48(124)72(136)84(87)148)107(161)170-56(19-111)92(90(173-105(32)159)51(127)21-164-101(30)155)175-97(151)24-3-38(114)65(129)39(115)4-24/h1-19,50-51,55-57,89-95,109,112-149H,20-22H2/t50-,51+,55-,56+,57-,89+,90-,91-,92-,93+,94+,95+,109-/m1/s1 |
| SMILES |
[C@@H]12[C@H](O[C@H]3[C@@H]([C@@H]1OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1c(c4c(C(=O)OC3)cc(c(c4O)O)Oc3c(c(c(cc3C(=O)O[C@@H](C=O)[C@@H](OC(=O)c3cc(c(c(c3)O)O)O)[C@@H]3OC(=O)c4cc(Oc5c(C(=O)O2)cc(c(c5O)O)O)c(c(c4c2c(cc(c(c2O)O)Oc2c(c(c(cc2C(=O)O[C@H](C=O)[C@H]([C@@H]2[C@@H](COC(=O)c4c(c5c(C(=O)O2)cc(c(c5O)O)O)c(c(c(c4)O)O)O)O)OC(=O)c2cc(c(c(c2)O)O)O)O)O)O)C(=O)OC[C@@H]3O)O)O)O)O)O)c(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Lythraceae | Woodfordia fruticosa  | Ref. |
|
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