input word = C00039159

Metabolite InformationStructural formula
Name Eryloside P
(-)-Eryloside P
Formula C64H104O30
Mw 1352.66124199
CAS RN 928849-51-8
C_ID C00039159 ,
InChIKey TWNNTRBCJKBPIJ-JKHKDLNTNA-N
InChICode InChI=1S/C64H104O30/c1-25(2)26(3)9-10-27(4)28-14-18-64(60(81)82)30-11-12-37-61(5,6)38(15-16-62(37,7)29(30)13-17-63(28,64)8)90-58-53(94-57-48(79)43(74)40(71)33(19-65)86-57)50(32(69)23-84-58)91-55-47(78)42(73)36(24-85-55)89-56-49(80)45(76)51(35(21-67)88-56)92-59-52(44(75)41(72)34(20-66)87-59)93-54-46(77)39(70)31(68)22-83-54/h25,27-28,31-59,65-80H,3,9-24H2,1-2,4-8H3,(H,81,82)/t27-,28-,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+,56?,57+,58+,59+,62-,63-,64+/m1/s1
SMILES C1[C@@H](C([C@@H]2[C@](C1)(C1=C(CC2)[C@]2([C@](CC1)([C@H](CC2)[C@@H](CCC(=C)C(C)C)C)C)C(=O)O)C)(C)C)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]1[C@@H]([C@H]([C@H](CO1)O[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)O)O)CO)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Erylus formosus Ref.
zoom in