input word = C00014580

Metabolite InformationStructural formula
Name (-)-Blepharocalyxin B
Blepharocalyxin B
Formula C54H54O11
Mw 878.36661257
CAS RN 183254-62-8
C_ID C00014580 ,
InChIKey ZSUGETUQFKRFKC-FMEFQIFKNA-N
InChICode InChI=1S/C54H54O11/c1-64-48-32-47(61)50(46(36-15-26-43(59)27-16-36)4-2-3-39(55)19-6-34-9-22-41(57)23-10-34)53(63)51(48)52(62)49-38(14-5-33-7-20-40(56)21-8-33)31-45(30-13-35-11-24-42(58)25-12-35)65-54(49)37-17-28-44(60)29-18-37/h2,4-5,7-12,14-18,20-29,32,38-39,45-46,49,54-61,63H,3,6,13,19,30-31H2,1H3/b4-2+,14-5+/t38-,39-,45+,46-,49-,54-/m1/s1
SMILES c1c(ccc(c1)CC[C@@H](C/C=C/[C@@H](c1c(cc(c(c1O)C(=O)[C@H]1[C@@H](C[C@@H](O[C@@H]1c1ccc(cc1)O)CCc1ccc(cc1)O)/C=C/c1ccc(cc1)O)OC)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeAlpinia blepharocalyx Ref.
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