| Name |
Gleditsioside H |
| Formula |
C74H120O37 |
| Mw |
1600.75084485 |
| CAS RN |
253123-12-5 |
| C_ID |
C00039273
, 
|
| InChIKey |
BWRRQLLLUYJSQV-RCRZZZEJNA-N |
| InChICode |
InChI=1S/C74H120O37/c1-27-40(79)46(85)52(91)60(102-27)100-25-36-45(84)48(87)59(110-64-54(93)49(88)56(28(2)103-64)107-63-55(94)57(34(78)24-98-63)108-61-50(89)41(80)31(75)21-96-61)67(105-36)111-68(95)74-18-16-69(3,4)20-30(74)29-10-11-38-71(7)14-13-39(70(5,6)37(71)12-15-73(38,9)72(29,8)17-19-74)106-65-53(92)47(86)44(83)35(104-65)26-101-66-58(43(82)33(77)23-99-66)109-62-51(90)42(81)32(76)22-97-62/h10,27-28,30-67,75-94H,11-26H2,1-9H3/t27-,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+,60+,61-,62-,63-,64-,65-,66+,67-,71-,72+,73+,74-/m0/s1 |
| SMILES |
C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(C1)(C)C)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)O)O)CO[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)C)C)C)(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 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Gleditsia sinensis  | Ref. |
|
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