input word = C00064096

Metabolite InformationStructural formula
Name Dichotomin H
Formula C47H66N8O10
Mw 902.49019039
CAS RN 193672-86-5
C_ID C00064096
InChIKey VDGQKFIRUKWWGI-ZFVWOVSMSA-N
InChICode InChI=1S/C47H66N8O10/c1-7-27(4)38-44(62)48-28(5)46(64)54-21-11-16-37(54)43(61)53-39(29(6)56)45(63)50-34(24-30-13-9-8-10-14-30)40(58)51-35(25-31-17-19-32(57)20-18-31)47(65)55-22-12-15-36(55)42(60)49-33(23-26(2)3)41(59)52-38/h8-10,13-14,17-20,26-29,33-39,56-57H,7,11-12,15-16,21-25H2,1-6H3,(H,48,62)(H,49,60)(H,50,63)(H,51,58)(H,52,59)(H,53,61)/t27-,28-,29+,33-,34-,35-,36-,37?,38-,39-/m0/s1
SMILES CCC(C)C1NC(=O)C(CC(C)C)NC(=O)C2CCCN2C(=O)C(Cc2ccc(O)cc2)NC(=O)C(Cc2ccccc2)NC(=O)C(C(C)O)NC(=O)C2CCCN2C(=O)C(C)NC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeStellaria dichotoma Ref.
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