| Name |
Lancemaside B
(-)-Lancemaside B |
| Formula |
C63H100O31 |
| Mw |
1352.62485648 |
| CAS RN |
1039450-76-4 |
| C_ID |
C00030629
, 
|
| InChIKey |
DUJZKTGKEOIECZ-LMCATHCXNA-N |
| InChICode |
InChI=1S/C63H100O31/c1-23-45(89-52-44(79)46(27(66)21-84-52)90-51-40(75)34(69)26(65)20-83-51)39(74)43(78)53(86-23)93-49-47(91-54-41(76)36(71)35(70)29(19-64)87-54)28(67)22-85-56(49)94-57(82)63-16-15-58(2,3)17-25(63)24-9-10-31-60(6)13-12-33(88-55-42(77)37(72)38(73)48(92-55)50(80)81)59(4,5)30(60)11-14-61(31,7)62(24,8)18-32(63)68/h9,23,25-49,51-56,64-79H,10-22H2,1-8H3,(H,80,81)/t23-,25-,26+,27+,28-,29?,30-,31+,32+,33-,34-,35+,36-,37-,38-,39-,40+,41+,42+,43+,44+,45-,46-,47+,48-,49-,51-,52-,53-,54-,55+,56+,60-,61+,62+,63+/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](O[C@H]2[C@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]7O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]3(C)C[C@H]4O)OC[C@@H](O)[C@@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O[C@@H]1OC[C@@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Campanulaceae/Lobeliaceae | Codonopsis lanceolata  | Ref. |
|
|
zoom in
| Organism | Codonopsis lanceolata |
|---|
| Reference | Ichikawa,J.Nat.Med.,62,(2008),423 |
|---|
|
