input word = C00032642

Metabolite InformationStructural formula
Name 3beta,11alpha-Diacetoxy-12-ursene
Formula C34H54O4
Mw 526.40221021
CAS RN 5563-70-2
C_ID C00032642 ,
InChIKey BANQNHXOKALUMC-KCRMTPRHNA-N
InChICode InChI=1S/C34H54O4/c1-20-11-14-31(7)17-18-33(9)24(28(31)21(20)2)19-25(37-22(3)35)29-32(8)15-13-27(38-23(4)36)30(5,6)26(32)12-16-34(29,33)10/h19-21,25-29H,11-18H2,1-10H3/t20-,21+,25+,26+,27+,28+,29-,31-,32+,33-,34-/m1/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=C[C@@H]1OC(=O)C)[C@H]1[C@@](CC2)(CC[C@H]([C@@H]1C)C)C)C)C)C)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeFicus microcarpa L.f. Ref.
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