input word = C00033585

Metabolite InformationStructural formula
Name 7-Acetyldihydronomilin
7alpha-Acetoxydihydronomilin
Formula C30H38O10
Mw 558.24649744
CAS RN 66879-86-5
C_ID C00033585 ,
InChIKey GQQJGWLFWUBFAV-MTKZZPGCNA-N
InChICode InChI=1S/C30H38O10/c1-15(31)36-20-13-22(33)39-26(3,4)19-12-21(37-16(2)32)29(7)18(28(19,20)6)8-10-27(5)23(17-9-11-35-14-17)38-25(34)24-30(27,29)40-24/h9,11,14,18-21,23-24H,8,10,12-13H2,1-7H3/t18-,19+,20+,21-,23+,24-,27+,28+,29+,30-/m1/s1
SMILES [C@]123[C@]4([C@@H]([C@]5([C@@H](C[C@H]4OC(=O)C)C(OC(=O)C[C@@H]5OC(=O)C)(C)C)C)CC[C@]2([C@@H](OC(=O)[C@H]1O3)c1ccoc1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Cedrala odorata Ref.
zoom in