input word = C00049785

Metabolite InformationStructural formula
Name Dibalanocarpol
(-)-Dibalanocarpol
Formula C56H42O14
Mw 938.25745605
CAS RN 204644-73-5
C_ID C00049785 ,
InChIKey AETOAAQSGCSQKP-RLLPANQYNA-N
InChICode InChI=1S/C56H42O14/c57-29-9-1-25(2-10-29)51-45-37(17-33(61)21-41(45)65)47-49-39(19-35(63)23-43(49)69-53(47)27-5-13-31(59)14-6-27)55(51,67)56(68)40-20-36(64)24-44-50(40)48(54(70-44)28-7-15-32(60)16-8-28)38-18-34(62)22-42(66)46(38)52(56)26-3-11-30(58)12-4-26/h1-24,47-48,51-54,57-68H/t47-,48?,51+,52+,53+,54+,55-,56-/m1/s1
SMILES [C@@]1(c2c3[C@@H](c4c([C@@H]1c1ccc(cc1)O)c(cc(c4)O)O)[C@@H](Oc3cc(c2)O)c1ccc(cc1)O)(O)[C@]1(c2c3[C@@H](c4c([C@@H]1c1ccc(cc1)O)c(cc(c4)O)O)[C@@H](Oc3cc(c2)O)c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipterocarpaceaeHopea malibato Ref.
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