input word = C00060005

Metabolite InformationStructural formula
Name (12S,14aS)-1,2,3,5a,6,11,12,14a-Octahydro-5a,6-dihydroxy-12-(2-methyl-1-propen-1-yl)-5H,14H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole-5,14-dione
Formula C21H23N3O4
Mw 381.16885625
CAS RN 1474012-00-4
C_ID C00060005
InChIKey CSRLIYIWILNEDP-JPSDMNJMSA-N
InChICode InChI=1S/C21H23N3O4/c1-11(2)10-15-17-16(12-6-3-4-7-13(12)22-17)18(25)21(28)20(27)23-9-5-8-14(23)19(26)24(15)21/h3-4,6-7,10,14-15,18,22,25,28H,5,8-9H2,1-2H3/t14-,15-,18?,21?/m0/s1
SMILES CC(C)=CC1c2[nH]c3ccccc3c2C(O)C2(O)C(=O)N3CCCC3C(=O)N12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus Ref.
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