input word = C00044411

Metabolite InformationStructural formula
Name 1,3-Diacetyl-24-epi-polacandrin
(-)-1,3-Diacetyl-24-epi-polacandrin
Formula C34H56O7
Mw 576.40260414
CAS RN 651025-46-6
C_ID C00044411 ,
InChIKey WSLDSLPNFRQNCB-MIGKZKCANA-N
InChICode InChI=1S/C34H56O7/c1-19(35)39-26-18-27(40-20(2)36)34(10)23(29(26,3)4)12-15-31(7)24(34)17-22(37)28-21(11-14-32(28,31)8)33(9)16-13-25(41-33)30(5,6)38/h21-28,37-38H,11-18H2,1-10H3/t21-,22+,23-,24-,25+,26+,27+,28-,31+,32+,33-,34-/m0/s1
SMILES CC(=O)O[C@@H]1C[C@@H](OC(C)=O)[C@]2(C)[C@H]3C[C@@H](O)[C@@H]4[C@@H]([C@]5(C)CC[C@H](C(C)(C)O)O5)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMartyniaceaeIbicella lutea Ref.
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