input word = C00056870

Metabolite InformationStructural formula
Name Omphalotin F
Formula C69H115N13O15
Mw 1365.8635601
CAS RN 1143452-88-3
C_ID C00056870
InChIKey RQWKIZBDXZCZFW-CHFRBERFSA-N
InChICode InChI=1S/C69H115N13O15/c1-26-41(12)51-61(89)77(22)54(40(10)11)65(93)78(23)53(39(8)9)62(90)73(18)35-48(84)75(20)57(68(15,16)95)66(94)80(25)56(43(14)28-3)63(91)72(17)34-47(83)70-50(37(4)5)60(88)79(24)55(42(13)27-2)64(92)74(19)36-49(85)81-46(59(87)76(21)52(38(6)7)58(86)71-51)33-69(96)44-31-29-30-32-45(44)82(97)67(69)81/h29-32,37-43,46,50-57,67,95-97H,26-28,33-36H2,1-25H3,(H,70,83)(H,71,86)/t41-,42-,43-,46-,50-,51-,52-,53-,54-,55-,56-,57+,67+,69+/m0/s1
SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H]2C[C@@]3(O)c4ccccc4N(O)[C@H]3N2C(=O)CN(C)C(=O)[C@H]([C@@H](C)CC)N(C)C(=O)[C@H](C(C)C)NC(=O)CN(C)C(=O)[C@H]([C@@H](C)CC)N(C)C(=O)[C@H](C(C)(C)O)N(C)C(=O)CN(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMarasmiaceaeOmphalotus olearius Ref.
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