| Name |
Woodfordin B |
| Formula |
C75H54O48 |
| Mw |
1722.17845359 |
| CAS RN |
127243-66-7 |
| C_ID |
C00035427
, 
|
| InChIKey |
PWJROHFKBLXARN-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C75H54O48/c76-14-40(62(119-66(104)17-1-27(77)47(91)28(78)2-17)61-38(88)15-113-70(108)22-10-35(85)51(95)55(99)42(22)21-9-25(73(111)118-61)46(90)58(102)45(21)89)116-74(112)26-12-37(87)53(97)59(103)60(26)115-39-13-24-44(57(101)54(39)98)43-23(11-36(86)52(96)56(43)100)72(110)120-63-41(16-114-71(24)109)117-75(123-69(107)20-7-33(83)50(94)34(84)8-20)65(122-68(106)19-5-31(81)49(93)32(82)6-19)64(63)121-67(105)18-3-29(79)48(92)30(80)4-18/h1-14,38,40-41,61-65,75,77-103H,15-16H2/t38-,40+,41-,61-,62+,63-,64+,65-,75+/m1/s1 |
| SMILES |
[C@@H]1([C@@H](O[C@H]2[C@H]([C@@H]1OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1c(c3c(C(=O)OC2)cc(c(c3O)O)Oc2c(cc(c(c2O)O)O)C(=O)O[C@@H](C=O)[C@H](OC(=O)c2cc(c(c(c2)O)O)O)[C@H]2[C@@H](COC(=O)c3c(c4cc(C(=O)O2)c(c(c4O)O)O)c(c(c(c3)O)O)O)O)c(c(c(c1)O)O)O)OC(=O)c1cc(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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