Name |
Nephelioside I |
Formula |
C46H76O15 |
Mw |
868.51842176 |
CAS RN |
656253-22-4 |
C_ID |
C00043764
,
|
InChIKey |
JBHHSGRRSOLJHT-OHUGICFMNA-N |
InChICode |
InChI=1S/C46H76O15/c1-41(2)14-16-46(22-48)17-15-44(6)23(24(46)18-41)8-9-29-43(5)12-11-30(42(3,4)28(43)10-13-45(29,44)7)59-40-37(61-39-35(55)33(53)32(52)27(19-47)58-39)36(26(50)21-57-40)60-38-34(54)31(51)25(49)20-56-38/h8,24-40,47-55H,9-22H2,1-7H3/t24-,25-,26+,27+,28-,29+,30-,31-,32+,33-,34+,35+,36-,37+,38-,39-,40-,43-,44+,45+,46+/m0/s1 |
SMILES |
C1[C@]2([C@H](C([C@H](C1)O[C@@H]1OC[C@H]([C@@H]([C@H]1O[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)O)O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@]1(CC[C@@]1([C@H]2CC(CC1)(C)C)CO)C)C)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Sapindaceae | Nephelium maingayi | Ref. |
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zoom in
Organism | Nephelium maingayi | Reference | Ito,J.Nat.Prod.,67,(2004),201 |
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