Name |
Periperoxide A (-)-Periperoxide A |
Formula |
C70H110O27 |
Mw |
1382.72344831 |
CAS RN |
1095261-90-7 |
C_ID |
C00034105
,
|
InChIKey |
NKGACJXDDCQRIG-XXYXRXLSNA-N |
InChICode |
InChI=1S/C70H110O27/c1-32-24-48(77-12)57(75)65(82-32)90-42-18-21-67(10)41(25-42)16-17-43-44(67)19-22-68(11)45(43)20-23-70(68,76)39(8)88-54-29-50-62(37(6)86-54)96-97-69(31-81-50)30-51(79-14)61(38(7)95-69)93-53-27-47(73)58(34(3)84-53)91-52-26-46(72)59(35(4)83-52)92-55-28-49(78-13)60(36(5)85-55)94-66-64(89-40(9)71)63(80-15)56(74)33(2)87-66/h16,24,32-39,42-47,49-56,58-66,72-74,76H,17-23,25-31H2,1-15H3/t32-,33-,34-,35-,36-,37-,38-,39+,42+,43-,44+,45+,46-,47+,49+,50-,51-,52+,53+,54+,55+,56+,58-,59-,60-,61-,62-,63+,64-,65-,66+,67+,68+,69+,70+/m1/s1 |
SMILES |
C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3CC[C@@]1([C@@H](O[C@@H]1O[C@@H]([C@@H]2[C@@H](C1)OC[C@]1(OO2)O[C@@H]([C@H]([C@@H](C1)OC)O[C@H]1C[C@@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@@H]([C@H]([C@@H](C1)O)O[C@H]1C[C@@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1OC(=O)C)OC)O)C)OC)C)O)C)C)C)O)C)O[C@H]1O[C@@H](C=C(C1=O)OC)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Apocynaceae | Periploca forrestii Schltr. | Ref. |
Plantae | Apocynaceae | Periploca sepium Bge. | Ref. |
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