input word = C00017773

Metabolite InformationStructural formula
Name Rhizoxin
NSC 332598
WF 1360
Formula C35H47NO9
Mw 625.32508211
CAS RN 90996-54-6
C_ID C00017773 ,
InChIKey OWPCHSCAPHNHAV-JBOVPUPTNA-N
InChICode InChI=1S/C35H47NO9/c1-19(13-25-18-41-23(5)36-25)9-8-10-21(3)32(40-7)22(4)27-17-29(37)35(6)30(45-35)12-11-20(2)26-14-24(16-31(38)42-26)15-28-33(43-28)34(39)44-27/h8-13,18,20,22,24,26-30,32-33,37H,14-17H2,1-7H3/b9-8+,12-11+,19-13+,21-10+/t20-,22-,24+,26-,27?,28+,29+,30-,32+,33-,35-/m1/s1
SMILES Cc1nc(/C=C(/C=C/C=C(/[C@@H]([C@H](C)[C@@H]2C[C@@H]([C@@]3([C@@H](/C=C/[C@H]([C@H]4C[C@H](CC(=O)O4)C[C@H]4[C@H](C(=O)O2)O4)C)O3)C)O)OC)\C)\C)co1
Start Substs in Alk. Biosynthesis (Prediction) Secologanin
Organism
Kingdom Family Species Reference
FungiMucoraceaeRhizopus chinensis Ref.
FungiMucoraceaeRhizopus sp. No. F-1360 Ref.
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OrganismRhizopus sp. No. F-1360
ReferenceKiyoto,J.Antibiotics,39,(1986),762