| Name |
Eucarpanin T1
Cornusiin C |
| Formula |
C102H74O66 |
| Mw |
2354.24341743 |
| CAS RN |
108906-53-2 |
| C_ID |
C00035273
, 
|
| InChIKey |
QOIVMLZQXXRBOS-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C102H74O66/c103-17-54(160-91(143)23-1-35(106)63(123)36(107)2-23)88(166-92(144)24-3-37(108)64(124)38(109)4-24)85-50(121)21-156-96(148)31-15-52(73(133)79(139)61(31)59-29(99(151)163-85)11-45(116)69(129)77(59)137)158-84-34(14-48(119)72(132)82(84)142)102(154)162-56(19-105)90(168-94(146)26-7-41(112)66(126)42(113)8-26)87-51(122)22-157-97(149)32-16-53(74(134)80(140)62(32)60-30(100(152)165-87)12-46(117)70(130)78(60)138)159-83-33(13-47(118)71(131)81(83)141)101(153)161-55(18-104)89(167-93(145)25-5-39(110)65(125)40(111)6-25)86-49(120)20-155-95(147)27-9-43(114)67(127)75(135)57(27)58-28(98(150)164-86)10-44(115)68(128)76(58)136/h1-19,49-51,54-56,85-90,106-142H,20-22H2/t49-,50+,51-,54+,55+,56+,85-,86+,87-,88+,89-,90+/m1/s1 |
| SMILES |
O=CC(OC(=O)c1cc(O)c(O)c(O)c1Oc1cc2c(c(O)c1O)-c1c(cc(O)c(O)c1O)C(=O)OC(C(OC(=O)c1cc(O)c(O)c(O)c1)C(C=O)OC(=O)c1cc(O)c(O)c(O)c1Oc1cc3c(c(O)c1O)-c1c(cc(O)c(O)c1O)C(=O)OC(C(OC(=O)c1cc(O)c(O)c(O)c1)C(C=O)OC(=O)c1cc(O)c(O)c(O)c1)C(O)COC3=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 | Cornaceae/Aucubaceae/Garryaceae/Helwingiaceae | Cornus officinalis  | Ref. |
| Plantae | Lythraceae | Punica granatum | Ref. |
|
|
zoom in
| Organism | Punica granatum |
|---|
| Reference | Wu, S. et al., Molecules 22, (2017), 1606. |
|---|
|
