input word = C00044416

Metabolite InformationStructural formula
Name 11beta-Acetoxyergost-5-ene-3beta,12beta,16-triol
(-)-11beta-Acetoxyergost-5-ene-3beta,12beta,16-triol
Formula C30H50O5
Mw 490.36582471
CAS RN 495380-48-8
C_ID C00044416 ,
InChIKey WINQDQSWJYMIPD-DHHNZPSTNA-N
InChICode InChI=1S/C30H50O5/c1-16(2)17(3)8-9-18(4)25-24(33)15-23-22-11-10-20-14-21(32)12-13-29(20,6)26(22)27(35-19(5)31)28(34)30(23,25)7/h10,16-18,21-28,32-34H,8-9,11-15H2,1-7H3/t17-,18+,21-,22-,23-,24-,25-,26+,27+,28+,29-,30-/m0/s1
SMILES CC(=O)O[C@@H]1[C@H]2[C@@H](CC=C3C[C@@H](O)CC[C@@]32C)[C@@H]2CC(O)[C@H]([C@H](C)CC[C@H](C)C(C)C)[C@@]2(C)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Capnella lacertiliensis Ref.
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OrganismCapnella lacertiliensis
ReferenceWright,J.Nat.Prod.,66,(2003),157