input word = C00042600

Metabolite InformationStructural formula
Name Hygrocin B
Formula C28H29NO8
Mw 507.18931691
CAS RN 874384-70-0
C_ID C00042600 ,
InChIKey YCXQGZJYZGFQSB-SYKPFJGSNA-N
InChICode InChI=1S/C28H29NO8/c1-5-15-6-8-17(30)14(3)37-27(36)28(4)11-10-19(32)29-23-22(28)26(35)20-16(25(23)34)12-13(2)24(33)21(20)18(31)9-7-15/h6,8,10-12,14-15,17,30,33H,5,7,9H2,1-4H3,(H,29,32)/b8-6+/t14-,15+,17-,28-/m0/s1
SMILES CCC1/C=C/[C@H](O)[C@H](C)OC(=O)[C@@]2(C)C=CC(=O)NC3=C2C(=O)c2c(cc(C)c(O)c2C(=O)CC1)C3=O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces hygroscopicus Ref.
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