| Name |
Lobelinin A |
| Formula |
C75H81O42 |
| Mw |
1653.42024172 |
| CAS RN |
127201-68-7 |
| C_ID |
C00051306
|
| InChIKey |
RYUDHFHTQJJGSR-UHFFFAOYNA-O |
| InChICode |
InChI=1S/C75H80O42/c1-28-69(117-52(86)15-6-29-2-9-33(76)10-3-29)63(97)68(102)71(107-28)106-27-48-58(92)62(96)67(101)75(116-48)112-44-22-35-40(20-34(77)21-41(35)109-72-64(98)59(93)57(91)47(113-72)26-105-53(87)23-49(82)83)108-70(44)32-18-42(110-73-65(99)60(94)55(89)45(114-73)24-103-50(84)13-7-30-4-11-36(78)38(80)16-30)54(88)43(19-32)111-74-66(100)61(95)56(90)46(115-74)25-104-51(85)14-8-31-5-12-37(79)39(81)17-31/h2-22,28,45-48,55-69,71-75,89-102H,23-27H2,1H3,(H7-,76,77,78,79,80,81,82,83,84,85,86,88)/p+1 |
| SMILES |
CC1OC(OCC2OC(Oc3cc4c(OC5OC(COC(=O)COC=O)C(O)C(O)C5O)cc(O)cc4[o+]c3-c3cc(OC4OC(COC(=O)C=Cc5ccc(O)c(O)c5)C(O)C(O)C4O)c(O)c(OC4OC(COC(=O)C=Cc5ccc(O)c(O)c5)C(O)C(O)C4O)c3)C(O)C(O)C2O)C(O)C(O)C1OC(=O)C=Cc1ccc(O)cc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Campanulaceae/Lobeliaceae | Lobelia chinensis  | Ref. |
|
|
zoom in
| Organism | Lobelia chinensis |
|---|
| Reference | Yin, et al., Modern Study of Chinese Drugs and Clinical Applications (1), Xueyuan Press, Beijing, (1993).
Buckingham(Executive Editor), Dictionary of Natural Products, Chapman & Hall, 1994, Vol1-7
1995, Vol8
1996, Vol9
1997, Vol10
1998, Vol11 |
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