| Name |
Lobatoside J |
| Formula |
C70H110O36 |
| Mw |
1526.67767991 |
| CAS RN |
143519-42-0 |
| C_ID |
C00039636
, 
|
| InChIKey |
FGRRBJSRJCVDKZ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C70H110O36/c1-25-36(76)42(82)54(105-61-49(89)52(102-59-46(86)40(80)38(78)31(20-71)97-59)50(26(2)96-61)100-58-48(88)51(30(75)23-94-58)101-57-45(85)37(77)29(74)22-93-57)62(95-25)106-64(92)70-17-15-65(3,4)19-28(70)27-9-10-34-66(5)13-12-35(67(6,24-73)33(66)11-14-69(34,8)68(27,7)16-18-70)99-63-55(44(84)43(83)53(103-63)56(90)91)104-60-47(87)41(81)39(79)32(21-72)98-60/h9,24-26,28-55,57-63,71-72,74-89H,10-23H2,1-8H3,(H,90,91)/t25-,26-,28+,29+,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-,57+,58-,59+,60-,61+,62+,63-,66+,67-,68-,69-,70+/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]1O[C@H]([C@H]([C@@H]([C@H]1O)O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)CO)O)O)O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O)O[C@@H]1[C@H]([C@H]([C@@H](CO1)O)O)O)O)C)O)O)C)C)C)C)(C=O)C)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)CO)O)O)O)O)O)C(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cucurbitaceae | Actinostemma lobatum | Ref. |
|
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