input word = C00045273

Metabolite InformationStructural formula
Name Dadahol B
Formula C38H36O11
Mw 668.22576199
CAS RN 405281-77-8
C_ID C00045273 ,
InChIKey QXHQDOXKUWAPCH-NEGJHZKENA-N
InChICode InChI=1S/C38H36O11/c1-45-33-23-28(12-17-31(33)41)38(44)35(24-48-37(43)20-11-26-7-15-30(40)16-8-26)49-32-18-9-27(22-34(32)46-2)4-3-21-47-36(42)19-10-25-5-13-29(39)14-6-25/h3-20,22-23,35,38-41,44H,21,24H2,1-2H3/b4-3+,19-10+,20-11+/t35-,38+/m0/s1
SMILES COc1cc(C(O)C(COC(=O)/C=C/c2ccc(O)cc2)Oc2ccc(/C=C/COC(=O)/C=C/c3ccc(O)cc3)cc2OC)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeArtocarpus dadah Ref.
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