input word = C00042587

Metabolite InformationStructural formula
Name Hirsutatin B
(-)-Hirsutatin B
Formula C35H54ON4O11
Mw 722.37382322
CAS RN 872195-17-0
C_ID C00042587 ,
InChIKey ZYONQIAFAWQOOQ-LFXJBRAGNA-N
InChICode InChI=1S/C35H54N4O11/c1-18(2)14-26-30(42)38-28(21(7)41)32(44)37-25(17-40)34(46)50-29(20(5)6)35(47)49-27(15-19(3)4)31(43)36-24(33(45)39(26)8)16-22-10-12-23(48-9)13-11-22/h10-13,18-21,24-29,40-41H,14-17H2,1-9H3,(H,36,43)(H,37,44)(H,38,42)/t21-,24+,25+,26+,27+,28-,29+/m1/s1
SMILES [C@H]1(NC(=O)[C@H](NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](OC(=O)[C@@H](OC1=O)C(C)C)CC(C)C)Cc1ccc(cc1)OC)C)CC(C)C)[C@H](O)C)CO
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
FungiClavicipitaceaeHirsutella nivea BCC2594 Ref.
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