| Name |
Parvimoside B |
| Formula |
C65H104O31 |
| Mw |
1380.65615661 |
| CAS RN |
872131-53-8 |
| C_ID |
C00042828
, 
|
| InChIKey |
HYVSBXYYXRGWQB-JCENMLJHNA-N |
| InChICode |
InChI=1S/C65H104O31/c1-25(2)11-10-16-64(8)53-29(69)19-63(7)28-12-13-35-61(4,5)36(15-17-62(35,6)27(28)14-18-65(53,63)60(82)96-64)91-59-52(40(74)34(24-85-59)90-57-47(81)51(39(73)33(22-68)88-57)94-56-43(77)41(75)37(71)31(20-66)87-56)95-55-44(78)42(76)48(26(3)86-55)92-54-45(79)49(30(70)23-84-54)93-58-46(80)50(83-9)38(72)32(21-67)89-58/h14,25-26,28,30-59,66-68,70-81H,10-13,15-24H2,1-9H3/t26-,28-,30-,31-,32-,33-,34-,35+,36+,37-,38-,39-,40+,41+,42-,43-,44-,45-,46-,47-,48-,49+,50+,51+,52-,53-,54+,55+,56+,57+,58+,59+,62-,63+,64+,65-/m1/s1 |
| SMILES |
C1=C2[C@H]([C@]3([C@]4(C1)[C@H](C(=O)C3)[C@@](OC4=O)(CCCC(C)C)C)C)CC[C@@H]1[C@@]2(CC[C@@H](C1(C)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)OC)O)CO)O)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Stichopus parvimensis | Ref. |
|
|
zoom in
| Organism | Stichopus parvimensis |
|---|
| Reference | Iniguez-Martinez,J.Nat.Prod.,68,(2005),1669 |
|---|
|
