input word = C00041048

Metabolite InformationStructural formula
Name Malacosterone
Formula C27H44O8
Mw 496.30361838
CAS RN 100665-32-5
C_ID C00041048 ,
InChIKey ZOKOAVXGNRAXRR-GJJRQPTPNA-N
InChICode InChI=1S/C27H44O8/c1-23(2,33)8-7-21(32)26(5,34)22-20(31)13-27(35)15-10-17(28)16-11-18(29)19(30)12-24(16,3)14(15)6-9-25(22,27)4/h10,14,16,18-22,29-35H,6-9,11-13H2,1-5H3/t14-,16-,18+,19-,20-,21+,22-,24+,25+,26-,27+/m0/s1
SMILES [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@](CC1)([C@H]([C@H](C2)O)[C@]([C@@H](CCC(C)(C)O)O)(O)C)C)O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTapinellaceaeTapinella panuoides Ref.
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