input word = C00052614

Metabolite InformationStructural formula
Name 20-hydroxycyclotryprostatin B
Formula C23H29N3O6
Mw 443.20563568
CAS RN 1363396-65-9
C_ID C00052614
InChIKey IQQGHQDLZFLSGU-YZQOHXRLSA-N
InChICode InChI=1S/C23H29N3O6/c1-22(2,29)11-16-18-17(13-8-7-12(31-3)10-14(13)24-18)19(32-4)23(30)21(28)25-9-5-6-15(25)20(27)26(16)23/h7-8,10,15-16,19,24,29-30H,5-6,9,11H2,1-4H3/t15-,16-,19-,23-/m0/s1
SMILES COc1ccc2c3c([nH]c2c1)[C@H](CC(C)(C)O)N1C(=O)[C@@H]2CCCN2C(=O)[C@@]1(O)[C@H]3OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus Ref.
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