input word = C00014885

Metabolite InformationStructural formula
Name [4S-[4R*,7S*,8R*,9R*,13E,16R*(E)]]-4,8-dihydroxy-13-(hydroxymethyl)-5,5,7,9-tetramethyl-16-[1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-oxacyclohexadec-13-ene-2,6-dione
(-)-26-Hydroxydesoxyepothilone B
26-Hydroxyepothilone D
Formula C27H41NO6S
Mw 507.26545878
CAS RN 201136-64-3
C_ID C00014885 ,
InChIKey MBIBPTIZDOCQGQ-YSVSGWBHNA-N
InChICode InChI=1S/C27H41NO6S/c1-16-8-7-9-20(14-29)10-11-22(17(2)12-21-15-35-19(4)28-21)34-24(31)13-23(30)27(5,6)26(33)18(3)25(16)32/h10,12,15-16,18,22-23,25,29-30,32H,7-9,11,13-14H2,1-6H3/b17-12+,20-10+/t16-,18+,22-,23-,25-/m0/s1
SMILES C1(=O)[C@@H]([C@H]([C@H](CCC/C(=C\C[C@H](OC(=O)C[C@@H](C1(C)C)O)/C(=C/c1nc(sc1)C)/C)/CO)C)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro
Organism
Kingdom Family Species Reference
--Amycolata autotrophica Ref.
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