input word = C00049220

Metabolite InformationStructural formula
Name Malayenolide B
(+)-Malayenolide B
Formula C29H34O7
Mw 494.23045344
CAS RN 225662-10-2
C_ID C00049220 ,
InChIKey GAGKMCOQPVBDOW-VRRXMISFNA-N
InChICode InChI=1S/C29H34O7/c1-16-11-12-23(35-27(32)19-9-7-6-8-10-19)28(4)22(14-20-17(2)26(31)34-21(20)13-16)29(5)25(36-29)15-24(28)33-18(3)30/h6-10,13,21-25H,11-12,14-15H2,1-5H3/b16-13-/t21-,22+,23-,24-,25-,28-,29+/m0/s1
SMILES CC(=O)O[C@H]1C[C@@H]2O[C@]2(C)[C@@H]2CC3=C(C)C(=O)O[C@H]3/C=C(/C)CC[C@H](OC(=O)c3ccccc3)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Veretillum malayense Ref.
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