| Name |
Stachyuranin A
Stachyuranin C |
| Formula |
C62H42O36 |
| Mw |
1362.14557774 |
| CAS RN |
172617-79-7 |
| C_ID |
C00009341
, 
|
| InChIKey |
JALFIMSSLUCMAC-IMPXUFIINA-N |
| InChICode |
InChI=1S/C62H42O36/c63-19-10-28-34(50-14(19)5-27(71)49(94-50)12-1-20(64)38(72)21(65)2-12)36-53-54(97-60(89)16-7-25(69)41(75)45(79)33(16)35-37(61(90)96-53)62(36,98-28)55(83)47(35)81)52-30(93-57(86)13-3-22(66)39(73)23(67)4-13)11-91-58(87)17-9-29(92-51-18(56(84)85)8-26(70)42(76)48(51)82)43(77)46(80)32(17)31-15(59(88)95-52)6-24(68)40(74)44(31)78/h1-4,6-10,27,30,36-37,49,52-54,63-82H,5,11H2,(H,84,85)/t27-,30+,36+,37+,49-,52+,53-,54-,62+/m0/s1 |
| SMILES |
O=C(OC1COC(=O)c2cc(Oc3c(C(=O)O)cc(O)c(O)c3O)c(O)c(O)c2-c2c(cc(O)c(O)c2O)C(=O)O[C@H]1[C@@H]1OC(=O)c2cc(O)c(O)c(O)c2C2=C(O)C(=O)C34Oc5cc(O)c6c(c5[C@@H]3C1OC(=O)[C@@H]24)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)C6)c1cc(O)c(O)c(O)c1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Myrtaceae | Psidium guajava  | Ref. |
| Plantae | Stachyuraceae | Stachyurus praecox | Ref. |
|
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