input word = C00024070

Metabolite InformationStructural formula
Name 24-Epi-acerinol
Formula C30H46O5
Mw 486.33452458
CAS RN 151061-95-9
C_ID C00024070 ,
InChIKey QSMBCFYTBUXTGE-JZYLITOQNA-N
InChICode InChI=1S/C30H46O5/c1-16-14-19-23(26(4,5)32)35-30(33-19)22(16)27(6)12-10-17-15-29-13-11-21(34-29)25(2,3)20(29)9-8-18(17)28(27,7)24(30)31/h16,19-24,31-32H,8-15H2,1-7H3/t16-,19-,20+,21+,22-,23-,24-,27-,28?,29+,30-/m1/s1
SMILES C[C@@H]1C[C@H]2O[C@]3(O[C@H]2C(C)(C)O)[C@H]1[C@@]1(C)CCC2=C(CC[C@H]4C(C)(C)[C@@H]5CC[C@@]4(C2)O5)[C@]1(C)[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeCimicifuga heracleifolia KOMAROV Ref.
zoom in