input word = C00017221

Metabolite InformationStructural formula
Name Ro 09-1468
Tetronothiodin
Formula C31H38O8S
Mw 570.22873892
CAS RN 139643-79-1
C_ID C00017221 ,
InChIKey WWHAZVYADWRKPA-SFYXYOTANA-N
InChICode InChI=1S/C31H38O8S/c1-17-10-8-9-13-21(32)12-7-5-4-6-11-20-14-18(2)19(3)15-31(20)28(35)24(30(38)39-31)25(33)22-16-40-27(23(17)22)26(34)29(36)37/h4-9,14,17,19-23,27,32,35H,10-13,15-16H2,1-3H3,(H,36,37)/b6-4+,7-5+,9-8+/t17-,19+,20-,21-,22-,23+,27+,31-/m1/s1
SMILES [C@H]1(C(=C[C@@H]2[C@@]3(C1)OC(=O)C(=C3O)C(=O)[C@H]1[C@H]([C@@H](C/C=C/C[C@@H](C/C=C/C=C/C2)O)C)[C@H](SC1)C(=O)C(=O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. NR0489 Ref.
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