input word = C00064093

Metabolite InformationStructural formula
Name Lawnermis acid
Formula C30H46O4
Mw 470.33960996
CAS RN 191669-59-7
C_ID C00064093
InChIKey DSUDGDOHSCPMSQ-NHCVMKFYSA-N
InChICode InChI=1S/C30H46O4/c1-18-9-14-30(17-31)16-15-27(4)20(24(30)19(18)2)7-8-21-26(3)12-11-23(32)29(6,25(33)34)22(26)10-13-28(21,27)5/h7,9,19,21-24,31-32H,8,10-17H2,1-6H3,(H,33,34)/t19-,21+,22+,23-,24-,26+,27+,28+,29-,30+/m0/s1
SMILES CC1=CCC2(CO)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C(=O)O)C5CCC43C)C2C1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLythraceaeLawsonia alba Ref.
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