Name |
Rubusside A |
Formula |
C40H64O11 |
Mw |
720.44486289 |
CAS RN |
577705-72-7 |
C_ID |
C00031250
,
|
InChIKey |
IFYBSXYNYSBLNA-JCLRAIEQNA-N |
InChICode |
InChI=1S/C40H64O11/c1-20(2)32-48-19-36(5)25-12-13-38(7)26(35(25,4)17-23(42)31(36)50-32)10-9-22-30-39(8,47)21(3)11-14-40(30,16-15-37(22,38)6)34(46)51-33-29(45)28(44)27(43)24(18-41)49-33/h9,20-21,23-33,41-45,47H,10-19H2,1-8H3/t21-,23-,24-,25-,26-,27-,28+,29-,30-,31+,32-,33+,35-,36+,37-,38-,39-,40+/m1/s1 |
SMILES |
[C@H]1(CC[C@]2([C@@H]([C@]1(C)O)C1=CC[C@H]3[C@]([C@@]1(CC2)C)(CC[C@@H]1[C@@]3(C)C[C@H]([C@H]2[C@]1(CO[C@H](O2)C(C)C)C)O)C)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Rosaceae | Rubus allegheniensis PORT. | Ref. |
|
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