input word = C00017220

Metabolite InformationStructural formula
Name Aldecalmycin
Formula C33H54O9
Mw 594.37678332
CAS RN 139953-58-5
C_ID C00017220 ,
InChIKey BKXWBAOGONGQJL-UIOPSBQENA-N
InChICode InChI=1S/C33H54O9/c1-8-9-18(3)28(37)21(6)24(41-32-31(40)30(39)29(38)25(16-35)42-32)15-23-19(4)14-22-13-17(2)12-20(5)27(22)33(23,7)26(36)10-11-34/h9,11,14,17,20-25,27-32,35,37-40H,8,10,12-13,15-16H2,1-7H3/b18-9+/t17-,20-,21+,22+,23+,24-,25+,27+,28-,29+,30-,31-,32+,33-/m0/s1
SMILES CC/C=C(C)C(O)C(C)C(CC1C(C)=CC2CC(C)CC(C)C2C1(C)C(=O)CC=O)O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Streptomyces Ref.
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OrganismStreptomyces
ReferenceSawa,J.Antibiotics 45,(1992),136