input word = C00045516

Metabolite InformationStructural formula
Name 14beta,15beta-Epoxy-21beta-hydroxyserratan-3-one
(-)-14beta,15beta-Epoxy-21beta-hydroxyserratan-3-one
Formula C30H48O3
Mw 456.3603454
CAS RN 362027-83-6
C_ID C00045516 ,
InChIKey WJQPKWTTWYJTHP-FAQQQZFNNA-N
InChICode InChI=1S/C30H48O3/c1-25(2)18-10-13-27(5)17-30-20(9-8-19(27)28(18,6)14-11-22(25)31)29(7)15-12-23(32)26(3,4)21(29)16-24(30)33-30/h18-21,23-24,32H,8-17H2,1-7H3/t18-,19-,20+,21-,23+,24+,27-,28-,29+,30-/m0/s1
SMILES C1C(=O)C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)(C[C@]23[C@@H]([C@@]4([C@@H](C[C@H]2O3)C([C@@H](CC4)O)(C)C)C)CC1)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePicea jezoensis var.jezoensis Ref.
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