Metabolite

KNApSAcK Entry

id C00038346
Name Acanthophylloside C
CAS RN 57579-58-5
Standard InChI InChI=1S/C92H146O53/c1-29-44(100)50(106)57(113)79(128-29)141-71-62(118)67(137-80-61(117)54(110)66(30(2)129-80)136-77-64(120)69(36(99)25-125-77)139-78-65(121)68(35(98)26-126-78)138-75-55(111)45(101)34(97)24-124-75)31(3)130-84(71)145-86(123)92-18-16-87(4,5)20-33(92)32-10-11-42-88(6)14-13-43(89(7,28-96)41(88)12-15-91(42,9)90(32,8)17-19-92)135-85-72(142-82-59(115)52(108)47(103)38(22-94)132-82)63(119)70(73(143-85)74(122)144-83-60(116)53(109)48(104)39(23-95)133-83)140-76-56(112)49(105)40(27-127-76)134-81-58(114)51(107)46(102)37(21-93)131-81/h10,28-31,33-73,75-85,93-95,97-121H,11-27H2,1-9H3
Standard InChI (Main Layer) InChI=1S/C92H146O53/c1-29-44(100)50(106)57(113)79(128-29)141-71-62(118)67(137-80-61(117)54(110)66(30(2)129-80)136-77-64(120)69(36(99)25-125-77)139-78-65(121)68(35(98)26-126-78)138-75-55(111)45(101)34(97)24-124-75)31(3)130-84(71)145-86(123)92-18-16-87(4,5)20-33(92)32-10-11-42-88(6)14-13-43(89(7,28-96)41(88)12-15-91(42,9)90(32,8)17-19-92)135-85-72(142-82-59(115)52(108)47(103)38(22-94)132-82)63(119)70(73(143-85)74(122)144-83-60(116)53(109)48(104)39(23-95)133-83)140-76-56(112)49(105)40(27-127-76)134-81-58(114)51(107)46(102)37(21-93)131-81/h10,28-31,33-73,75-85,93-95,97-121H,11-27H2,1-9H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 49

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN