input word = C00002362

Metabolite InformationStructural formula
Name Sirodesmin H
Formula C20H26N2O8S
Mw 454.14098655
CAS RN 64542-78-5
C_ID C00002362 ,
InChIKey ITMLCHOGYDYPNT-PRKFEUHFNA-N
InChICode InChI=1S/C20H26N2O8S/c1-9-16(3,4)12(25)18(30-9)6-11-17(28,13(18)29-10(2)24)7-19-14(26)21(5)20(8-23,31-19)15(27)22(11)19/h9,11,13,23,28H,6-8H2,1-5H3/t9-,11-,13+,17+,18-,19-,20-/m1/s1
SMILES [C@H]12[C@]([C@@H]([C@@]3(C1)C(=O)C([C@H](O3)C)(C)C)OC(=O)C)(C[C@]13N2C(=O)[C@](N(C1=O)C)(S3)CO)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Ala
Organism
Kingdom Family Species Reference
FungiIncertae sedisPhoma lingam Ref.
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OrganismPhoma lingam
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter31