| Name |
Nobotanin B |
| Formula |
C82H56O52 |
| Mw |
1872.17376215 |
| CAS RN |
104696-16-4 |
| C_ID |
C00035345
, 
|
| InChIKey |
QWKVPQOCGYJDNW-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C82H56O52/c83-26-1-16(2-27(84)47(26)95)71(112)122-14-39-66(68-69(81(125-39)133-72(113)17-3-28(85)48(96)29(86)4-17)131-78(119)23-11-36(93)53(101)60(108)44(23)43-21(76(117)130-68)9-34(91)52(100)59(43)107)128-80(121)25-12-37(94)55(103)63(111)64(25)124-38-13-24-46(62(110)56(38)104)45-22(10-35(92)54(102)61(45)109)77(118)129-67-65-40(126-82(70(67)132-79(24)120)134-73(114)18-5-30(87)49(97)31(88)6-18)15-123-74(115)19-7-32(89)50(98)57(105)41(19)42-20(75(116)127-65)8-33(90)51(99)58(42)106/h1-13,39-40,65-70,81-111H,14-15H2/t39-,40-,65+,66-,67+,68+,69+,70+,81-,82+/m1/s1 |
| SMILES |
c12c3c(C(=O)OC[C@@H]4[C@H](OC(=O)c1cc(c(c2O)O)O)[C@H]1[C@@H]([C@@H](O4)OC(=O)c2cc(c(c(c2)O)O)O)OC(=O)c2c(c4c(C(=O)O1)cc(c(c4O)O)O)c(c(c(c2)Oc1c(cc(c(c1O)O)O)C(=O)O[C@@H]1[C@H](O[C@@H]([C@@H]2[C@H]1OC(=O)c1c(c4c(C(=O)O2)cc(c(c4O)O)O)c(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)COC(=O)c1cc(c(c(c1)O)O)O)O)O)cc(c(c3O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Melastomataceae | Bredia tuberuculata | Ref. |
| Plantae | Melastomataceae | Monochaetum malabathuricum | Ref. |
| Plantae | Melastomataceae | Monochaetum multiflorum | Ref. |
| Plantae | Melastomataceae | Monochaetum normale | Ref. |
| Plantae | Melastomataceae | Tibouchina multiflora | Ref. |
|
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