input word = C00015135

Metabolite InformationStructural formula
Name Sordarin-1-glucose ester
Formula C33H50O13
Mw 654.32514168
CAS RN 398118-00-8
C_ID C00015135 ,
InChIKey NLDDAQSAGIEQAK-JERFDNGSNA-N
InChICode InChI=1S/C33H50O13/c1-14(2)20-8-17-9-31(12-35)19-7-6-15(3)18(19)10-32(17,13-43-28-26(40)24(38)27(42-5)16(4)44-28)33(20,31)30(41)46-29-25(39)23(37)22(36)21(11-34)45-29/h8,12,14-19,21-29,34,36-40H,6-7,9-11,13H2,1-5H3/t15-,16-,17+,18-,19-,21+,22-,23+,24-,25-,26-,27-,28-,29+,31+,32+,33+/m1/s1
SMILES CO[C@@H]1C(C)O[C@@H](OC[C@@]23C[C@@H]4[C@H](C)CC[C@H]4[C@@]4(C=O)C[C@@H]2C=C(C(C)C)[C@@]34C(=O)O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)C(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMucoraceaeRhizopus japonicus IMI 21600 Ref.
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