| Name |
Gleditsioside D
(-)-Gleditsioside D |
| Formula |
C84H134O41 |
| Mw |
1798.84005379 |
| CAS RN |
230302-73-5 |
| C_ID |
C00049168
, 
|
| InChIKey |
AEPZIZXGVQDNGR-TWBPKQOGNA-N |
| InChICode |
InChI=1S/C84H134O41/c1-12-80(8,108)19-13-14-33(2)68(106)109-31-42-53(96)56(99)66(124-75-67(123-73-60(103)54(97)51(94)41(26-85)116-73)61(104)63(34(3)115-75)120-71-62(105)64(40(89)30-112-71)121-69-57(100)48(91)37(86)27-110-69)76(118-42)125-77(107)84-23-22-78(4,5)24-36(84)35-15-16-45-81(9)20-18-47(79(6,7)44(81)17-21-82(45,10)83(35,11)25-46(84)90)119-72-59(102)55(98)52(95)43(117-72)32-114-74-65(50(93)39(88)29-113-74)122-70-58(101)49(92)38(87)28-111-70/h12,14-15,34,36-67,69-76,85-105,108H,1,13,16-32H2,2-11H3/b33-14+/t34-,36-,37+,38+,39+,40+,41+,42+,43+,44-,45+,46+,47-,48-,49-,50+,51+,52-,53-,54-,55-,56-,57+,58+,59+,60+,61+,62+,63-,64-,65-,66+,67+,69-,70-,71-,72-,73-,74+,75-,76-,80+,81-,82+,83+,84+/m0/s1 |
| SMILES |
C1[C@@H]2[C@](CCC1(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]1OC[C@H]([C@@H]([C@H]1O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)O)COC(=O)/C(=C/CC[C@@](C=C)(O)C)/C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Gleditsia sinensis  | Ref. |
|
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