input word = C00036198

Metabolite InformationStructural formula
Name Phyllostadimer B
Formula C42H50O16
Mw 810.30988555
CAS RN 638203-38-0
C_ID C00036198 ,
InChIKey LXZQSRKEZKPRBC-QUKNIQNJNA-N
InChICode InChI=1S/C42H50O16/c1-49-29-11-21(7-9-27(29)43)37(45)35-19-57-41(23-13-31(51-3)39(47)32(14-23)52-4)25(17-55-35)26-18-56-36(38(46)22-8-10-28(44)30(12-22)50-2)20-58-42(26)24-15-33(53-5)40(48)34(16-24)54-6/h7-16,25-26,35-38,41-48H,17-20H2,1-6H3/t25-,26+,35-,36-,37+,38+,41-,42+/m0/s1
SMILES [C@H]1([C@@H]2CO[C@@H](CO[C@H]2c2cc(c(c(c2)OC)O)OC)[C@@H](c2cc(c(cc2)O)OC)O)CO[C@@H](CO[C@@H]1c1cc(c(c(c1)OC)O)OC)[C@H](O)c1cc(c(cc1)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaePhyllostachys edulis Ref.
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