input word = C00013498

Metabolite InformationStructural formula
Name Carpelastofuran
6,7,10,11-Tetrahydro-3,9-dihydroxy-6,11-bis(1-hydroxy-1-methylethyl)-13-(3-methyl-2-butenyl)-8H-furo[3',2':6,7][1]benzopyrano[3,2-d][1]benzoxepin-8-one
Formula C30H34O8
Mw 522.22536806
CAS RN 404889-57-2
C_ID C00013498 ,
InChIKey CMAJARWNSTVDIA-UHFFFAOYNA-N
InChICode InChI=1S/C30H34O8/c1-14(2)7-9-17-27-19(13-22(37-27)30(5,6)35)25(33)23-24(32)18-12-21(29(3,4)34)36-20-11-15(31)8-10-16(20)26(18)38-28(17)23/h7-8,10-11,21-22,31,33-35H,9,12-13H2,1-6H3/t21-,22-/m1/s1
SMILES c12c(oc3c(c1=O)C[C@@H](Oc1c3ccc(c1)O)C(C)(C)O)c(c1c(c2O)C[C@@H](O1)C(O)(C)C)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeArtocarpus elasticus Ref.
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OrganismArtocarpus elasticus
ReferenceCidade,Planta Med.,67,(2001),867