| 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 |
O=CC(OC(=O)c1cc(O)c(O)c(O)c1Oc1cc2c(c(O)c1O)-c1c3cc(c(O)c1O)Oc1c(cc(O)c(O)c1O)C(=O)OC1C(OC(=O)c4cc(O)c(O)c(O)c4)OC4COC(=O)c5cc(c(O)c(O)c5-c5c(cc(O)c(O)c5O)C(=O)OC4C1OC(=O)c1cc(O)c(O)c(O)c1)Oc1c(cc(O)c(O)c1O)C(=O)OC(C=O)C(OC(=O)c1cc(O)c(O)c(O)c1)C(OC3=O)C(O)COC2=O)C(OC(=O)c1cc(O)c(O)c(O)c1)C1OC(=O)c2cc(O)c(O)c(O)c2-c2c(cc(O)c(O)c2O)C(=O)OCC1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Lythraceae | Woodfordia fruticosa  | Ref. |
|
|
zoom in
|
