input word = C00033353

Metabolite InformationStructural formula
Name Saponaceoic acid III
(-)-Saponaceoic acid III
Formula C30H48O4
Mw 472.35526002
CAS RN 500307-50-6
C_ID C00033353 ,
InChIKey SKTOHBBYPZVTFX-RUDCIGKKNA-N
InChICode InChI=1S/C30H48O4/c1-18(2)23(31)10-8-19(26(33)34)20-12-16-30(7)22-9-11-24-27(3,4)25(32)14-15-28(24,5)21(22)13-17-29(20,30)6/h19-20,23-25,31-32H,1,8-17H2,2-7H3,(H,33,34)/t19-,20-,23-,24+,25+,28-,29-,30+/m1/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)(C1=C(CC2)[C@]2([C@](CC1)([C@H](CC2)[C@@H](CC[C@H](C(=C)C)O)C(=O)O)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTricholomataceaeTricholoma saponaceum Ref.
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