input word = C00055336

Metabolite InformationStructural formula
Name Chondrillast-7-enol
Formula C29H50O
Mw 414.38616622
CAS RN 18525-35-4
C_ID C00055336
InChIKey YSKVBPGQYRAUQO-XCFYOIDPSA-N
InChICode InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h11,19-23,25-27,30H,7-10,12-18H2,1-6H3/t20-,21+,22+,23+,25-,26+,27+,28+,29-/m1/s1
SMILES CC[C@H](C(C)C)CC[C@H]([C@@]1([H])CC[C@@]2([H])C([C@]3([H])CC[C@]12C)=CC[C@@]4([H])C[C@@H](O)CC[C@@]43C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Mytilus edulis Ref.
--Perna canaliculus Ref.
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