input word = C00043375

Metabolite InformationStructural formula
Name Certonardosterol D5
Formula C28H50O5
Mw 466.36582471
CAS RN 781646-88-6
C_ID C00043375 ,
InChIKey URQOCKLOSGLGQT-ZAXWZQKENA-N
InChICode InChI=1S/C28H50O5/c1-16(2)28(33,15-29)11-6-17(3)21-14-24(32)25-19-13-23(31)22-12-18(30)7-9-26(22,4)20(19)8-10-27(21,25)5/h16-25,29-33H,6-15H2,1-5H3/t17-,18+,19-,20+,21-,22-,23+,24-,25-,26-,27-,28-/m1/s1
SMILES CC(C)[C@](O)(CO)CC[C@@H](C)[C@H]1C[C@@H](O)[C@H]2[C@@H]3C[C@H](O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Certonardoa semiregularis Ref.
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OrganismCertonardoa semiregularis
ReferenceWang,J.Nat.Prod.,67,(2004),1654