| Name |
Proceraoside B |
| Formula |
C95H152O44 |
| Mw |
1996.96564823 |
| CAS RN |
205305-44-8 |
| C_ID |
C00049891
, 
|
| InChIKey |
HQJDTNQUMAVTSG-DFFMSMSXNA-N |
| InChICode |
InChI=1S/C95H152O44/c1-16-90(11,121)26-18-20-40(4)78(119)133-72-41(5)126-84(70(116)65(72)111)139-91(12,17-2)27-19-21-39(3)77(118)131-55-32-95(87(120)138-86-76(64(110)59(105)48(34-97)129-86)137-83-71(117)74(135-82-69(115)62(108)58(104)47(33-96)127-82)73(42(6)125-83)134-81-67(113)60(106)49(35-98)128-81)44(30-88(55,7)8)43-22-23-52-92(13)28-25-54(89(9,10)51(92)24-29-93(52,14)94(43,15)31-53(95)101)132-80-68(114)63(109)61(107)50(130-80)38-124-85-75(57(103)46(100)37-123-85)136-79-66(112)56(102)45(99)36-122-79/h16-17,20,22,39,41-42,44-76,79-86,96-117,121H,1-2,18-19,21,23-38H2,3-15H3/b40-20+/t39-,41+,42-,44-,45+,46-,47+,48+,49-,50+,51-,52+,53+,54-,55-,56-,57-,58+,59+,60-,61+,62-,63-,64-,65+,66+,67+,68+,69+,70+,71+,72+,73-,74-,75+,76+,79-,80-,81-,82-,83+,84-,85-,86-,90+,91+,92-,93+,94+,95+/m0/s1 |
| SMILES |
C1[C@@H]2[C@](C[C@@H](C1(C)C)OC(=O)[C@@H](C)CCC[C@](C)(O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)OC(=O)/C(=C\CC[C@@](C=C)(O)C)/C)C)C=C)([C@@H](C[C@@]1(C2=CC[C@H]2[C@]1(CC[C@@H]1[C@@]2(CC[C@@H](C1(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)C)C)C)O)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O[C@H]1[C@@H]([C@H]([C@@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Albizia procera  | Ref. |
|
|
zoom in
| Organism | Albizia procera |
|---|
| Reference | Yoshikawa,J.Nat.Prod.,61,(1998),440 |
|---|
|
