input word = C00018055

Metabolite InformationStructural formula
Name Rapamycin
Formula C51H79NO13
Mw 913.55514162
CAS RN 53123-88-9
C_ID C00018055 ,
InChIKey QFJCIRLUMZQUOT-ISIIWDMJNA-N
InChICode InChI=1S/C51H79NO13/c1-30-16-12-11-13-17-31(2)42(61-8)28-38-21-19-36(7)51(60,65-38)48(57)49(58)52-23-15-14-18-39(52)50(59)64-43(33(4)26-37-20-22-40(53)44(27-37)62-9)29-41(54)32(3)25-35(6)46(56)47(63-10)45(55)34(5)24-30/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,56,60H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12+,31-17+,35-25+/t30-,32-,33-,34-,36-,37+,38+,39+,40-,42+,43+,44-,46-,47+,51-/m1/s1
SMILES N12C(=O)C(=O)[C@@]3(O[C@H](C[C@@H](/C(=C/C=C/C=C/[C@H](C[C@H](C(=O)[C@@H]([C@@H](/C(=C/[C@H](C(=O)C[C@H](OC(=O)[C@@H]1CCCC2)[C@@H](C[C@H]1C[C@H]([C@@H](CC1)O)OC)C)C)/C)O)OC)C)C)/C)OC)CC[C@H]3C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces hygroscopicus AY B-994 Ref.
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OrganismStreptomyces hygroscopicus AY B-994
ReferenceVezina,J. Antibiotics,28,(1975),721