input word = C00015133

Metabolite InformationStructural formula
Name 2'-O-Acetylsordarin
Formula C29H42O9
Mw 534.28288294
CAS RN 398117-98-1
C_ID C00015133 ,
InChIKey CQEKPQJDWBHIQF-JLGVSBKZNA-N
InChICode InChI=1S/C29H42O9/c1-14(2)21-9-18-10-27(12-30)20-8-7-15(3)19(20)11-28(18,29(21,27)26(33)34)13-36-25-24(38-17(5)31)22(32)23(35-6)16(4)37-25/h9,12,14-16,18-20,22-25,32H,7-8,10-11,13H2,1-6H3,(H,33,34)/t15-,16-,18+,19-,20-,22+,23-,24-,25-,27+,28+,29+/m1/s1
SMILES [C@@H]12[C@H]([C@@]3([C@@]4([C@](C1)([C@@H](C=C4C(C)C)C3)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C)OC)O)OC(=O)C)C(=O)O)C=O)CC[C@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus awamori NRRL 3112 Ref.
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