input word = C00027702

Metabolite InformationStructural formula
Name 19,20-Epoxycytochalasin D
Formula C30H37NO7
Mw 523.25700254
CAS RN 191349-10-7
C_ID C00027702 ,
InChIKey WHJRAYUHVRYTTH-HJDFZNLSNA-N
InChICode InChI=1S/C30H37NO7/c1-15-10-9-13-20-23(33)17(3)16(2)22-21(14-19-11-7-6-8-12-19)31-28(35)30(20,22)27(37-18(4)32)24-26(38-24)29(5,36)25(15)34/h6-9,11-13,15-16,20-24,26-27,33,36H,3,10,14H2,1-2,4-5H3,(H,31,35)/b13-9+/t15-,16+,20-,21-,22-,23+,24+,26+,27+,29-,30-/m0/s1
SMILES [C@H]12[C@@](C(=O)[C@H](C/C=C/[C@@H]3[C@@]4([C@@H]([C@@H]1O2)OC(=O)C)[C@@H]([C@@H](C(=C)[C@H]3O)C)[C@@H](NC4=O)Cc1ccccc1)C)(C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-Phe
Organism
Kingdom Family Species Reference
FungiXylariaceaeXylaria hypoxylon Ref.
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OrganismXylaria hypoxylon
ReferenceEspada,Tetrahedron,53,(1997),6485