input word = C00018763

Metabolite InformationStructural formula
Name Rugulosin
(+)-Rugulosin
NSC 160880
NSC 249990
Formula C30H22O10
Mw 542.12129692
CAS RN 23537-16-8
C_ID C00018763 ,
InChIKey OYNIPTDPTUSUAY-UHFFFAOYNA-N
InChICode InChI=1S/C30H22O10/c1-7-3-9-13(11(31)5-7)21(33)17-25(37)20-23(35)15-16-24(36)19(29(15,17)27(9)39)26(38)18-22(34)14-10(28(40)30(16,18)20)4-8(2)6-12(14)32/h3-6,15-16,19-20,23-24,31-32,35-38H,1-2H3/t15-,16-,19+,20+,23-,24-,29+,30+/m1/s1
SMILES c1(cc(c2c(c1)C(=O)[C@@]13C(=C([C@H]4[C@]56C(=C([C@@H]1[C@@H]([C@H]6[C@@H]3[C@H]4O)O)O)C(=O)c1c(C5=O)cc(cc1O)C)O)C2=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sepedonium ampullosporum Ref.
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