Name |
Pursaethoside D (-)-Pursaethoside D |
Formula |
C64H103NO31 |
Mw |
1381.65140558 |
CAS RN |
865364-26-7 |
C_ID |
C00042895
,
|
InChIKey |
LYLWZPIVCDQKOU-KAJMJBTLNA-N |
InChICode |
InChI=1S/C64H103NO31/c1-26(69)65-36-44(94-52-41(76)38(73)30(71)20-86-52)39(74)32(21-87-51-40(75)37(72)29(70)19-85-51)91-50(36)92-35-12-13-59(6)33(58(35,4)5)11-14-60(7)34(59)10-9-27-28-17-57(2,3)15-16-64(28,47(79)46(78)61(27,60)8)56(82)96-53-45(95-55-49(81)63(84,23-68)25-89-55)42(77)43(31(18-66)90-53)93-54-48(80)62(83,22-67)24-88-54/h9,28-55,66-68,70-81,83-84H,10-25H2,1-8H3,(H,65,69)/t28-,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-,59-,60+,61-,62+,63+,64+/m0/s1 |
SMILES |
C1[C@]2([C@H](C([C@H](C1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1NC(=O)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)CO[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@]1([C@H]([C@H]([C@@]1([C@H]2CC(CC1)(C)C)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]1OC[C@]([C@H]1O)(O)CO)O)O[C@H]1OC[C@]([C@H]1O)(O)CO)CO)O)O)C)C)C |
Start Substs in Alk. Biosynthesis (Prediction) |
L-Arg Cholesterol |
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Fabaceae | Entada pursaetha | Ref. |
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Organism | Entada pursaetha | Reference | Leon,J.Nat.Prod.,68,(2005),1185 |
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