input word = C00018168

Metabolite InformationStructural formula
Name Antibiotic T 42082
Carriomycin
Formula C47H80O15
Mw 884.54972189
CAS RN 65978-43-0
C_ID C00018168 ,
InChIKey XVEWEQLVOJZMCV-UHFFFAOYNA-N
InChICode InChI=1S/C47H80O15/c1-23-20-24(2)45(10,50)61-40(23)35-15-14-33(56-35)34-16-18-38(57-34)44(9)42(54-13)28(6)47(62-44)26(4)37(53-12)22-31(59-47)21-36-25(3)41(27(5)46(51,60-36)29(7)43(48)49)58-39-19-17-32(52-11)30(8)55-39/h23-42,50-51H,14-22H2,1-13H3,(H,48,49)/t23-,24+,25+,26+,27-,28-,29-,30-,31-,32-,33+,34-,35-,36+,37-,38-,39-,40-,41+,42-,44+,45+,46+,47+/m1/s1
SMILES [C@]1(O[C@H]([C@@H]([C@@H]([C@H]1C)O[C@@H]1CC[C@H]([C@H](O1)C)OC)C)C[C@@H]1C[C@H]([C@@H]([C@@]2(O1)[C@@H]([C@H]([C@](O2)(C)[C@H]1CC[C@@H](O1)[C@@H]1CC[C@@H](O1)[C@H]1[C@@H](C[C@@H]([C@@](O1)(C)O)C)C)OC)C)C)OC)([C@H](C)C(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces hygroscopicus T-42082 Ref.
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OrganismStreptomyces hygroscopicus T-42082
ReferenceImada,J. Antibiotics,31,(1978),7