| Name |
Nobotanin H |
| Formula |
C89H60O57 |
| Mw |
2040.17963539 |
| CAS RN |
113900-93-9 |
| C_ID |
C00035349
, 
|
| InChIKey |
POFRGFDEOBQXMX-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C89H60O57/c90-28-1-17(2-29(91)50(28)102)78(123)133-15-42-72(74-76(88(137-42)145-79(124)18-3-30(92)51(103)31(93)4-18)144-84(129)22-9-36(98)55(107)63(115)46(22)48-24(85(130)142-74)13-40(59(111)65(48)117)135-69-26(77(121)122)11-38(100)57(109)67(69)119)140-87(132)27-12-39(101)58(110)68(120)70(27)136-41-14-25-49(66(118)60(41)112)47-23(10-37(99)56(108)64(47)116)83(128)143-75-73(141-86(25)131)71-43(138-89(75)146-80(125)19-5-32(94)52(104)33(95)6-19)16-134-81(126)20-7-34(96)53(105)61(113)44(20)45-21(82(127)139-71)8-35(97)54(106)62(45)114/h1-14,42-43,71-76,88-120H,15-16H2,(H,121,122)/t42-,43+,71-,72+,73+,74-,75+,76+,88+,89+/m1/s1 |
| SMILES |
Oc1cc2c(c(c1O)O)c1c(cc(c(c1O)O)O)C(=O)O[C@@H]1[C@H](COC2=O)O[C@H]([C@@H]2[C@H]1OC(=O)c1c(c3c(C(=O)O2)cc(c(c3O)O)O)c(c(c(c1)Oc1c(c(c(cc1C(=O)O[C@H]1[C@H](O[C@H]([C@@H]2[C@@H]1OC(=O)c1c(c3c(C(=O)O2)cc(c(c3O)O)O)c(c(c(c1)Oc1c(c(c(cc1C(=O)O)O)O)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)COC(=O)c1cc(c(c(c1)O)O)O)O)O)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Melastomataceae | Monochaetum malabathuricum | Ref. |
| Plantae | Melastomataceae | Monochaetum normale | Ref. |
|
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