Name |
Abutiloside M (-)-Abutiloside M |
Formula |
C52H84O23 |
Mw |
1076.54033899 |
CAS RN |
652144-59-7 |
C_ID |
C00036026
,
|
InChIKey |
DYVAXAUOLHCWSG-SRWUNIBLNA-N |
InChICode |
InChI=1S/C52H84O23/c1-20-32-28(74-52(20)13-12-49(4,75-52)19-66-45-39(61)38(60)35(57)29(17-53)70-45)16-26-31-25(9-11-51(26,32)6)50(5)10-8-24(14-23(50)15-27(31)65-7)69-48-44(73-47-41(63)37(59)34(56)22(3)68-47)42(64)43(30(18-54)71-48)72-46-40(62)36(58)33(55)21(2)67-46/h15,20-22,24-48,53-64H,8-14,16-19H2,1-7H3/t20-,21-,22-,24-,25-,26-,27+,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-/m0/s1 |
SMILES |
O1[C@@]2([C@H]([C@H]3[C@@H]1C[C@@H]1[C@@]3(CC[C@H]3[C@H]1[C@@H](C=C1[C@@]3(CC[C@@H](C1)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)O)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)CO)C)OC)C)C)CC[C@](O2)(CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Solanaceae | Solanum abutiloides | Ref. |
|
|
zoom in
Organism | Solanum abutiloides | Reference | Yoshimitsu,Phytochem.,64,(2003),1361 |
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