input word = C00023802

Metabolite InformationStructural formula
Name Polyporenic acid D
3alpha-Hydroxy-4,4,14-trimethyl-5alpha-ergosta-8,24(28)-dien-26-oic acid
Formula C31H50O3
Mw 470.37599546
CAS RN 80162-09-0
C_ID C00023802 ,
InChIKey XFQRAXVAPABXQP-RPFWCMOGNA-N
InChICode InChI=1S/C31H50O3/c1-19(21(3)27(33)34)9-10-20(2)22-13-17-31(8)24-11-12-25-28(4,5)26(32)15-16-29(25,6)23(24)14-18-30(22,31)7/h20-22,25-26,32H,1,9-18H2,2-8H3,(H,33,34)/t20-,21-,22+,25+,26+,29+,30-,31+/m0/s1
SMILES C1[C@H](C([C@@H]2[C@](C1)(C1=C(CC2)[C@@]2([C@](CC1)(C)[C@H](CC2)[C@@H](C)CCC(=C)[C@@H](C(=O)O)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPolyporaceaePolyporus officinalis Ref.
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