input word = C00034035

Metabolite InformationStructural formula
Name Lycernuic acid A
Formula C30H48O4
Mw 472.35526002
CAS RN 53755-77-4
C_ID C00034035 ,
InChIKey RGIWJHUJDHZDIN-PCOMYLENNA-N
InChICode InChI=1S/C30H48O4/c1-26(2)20-9-7-18-17-27(3)14-11-22-29(5,16-13-24(32)30(22,6)25(33)34)21(27)10-8-19(18)28(20,4)15-12-23(26)31/h7,19-24,31-32H,8-17H2,1-6H3,(H,33,34)/t19-,20-,21-,22+,23+,24-,27-,28+,29+,30+/m0/s1
SMILES C1[C@H]2C(=CC[C@@H]3[C@@]2(CC[C@H](C3(C)C)O)C)C[C@]2([C@H](C1)[C@@]1([C@@H](CC2)[C@@]([C@H](CC1)O)(C)C(=O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLycopodiaceaeDiphasiastrum complanatum L.Holub Ref.
PlantaeLycopodiaceaeLycopodium cernuum Ref.
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OrganismLycopodium cernuum
ReferenceChinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999).

Zhang, et al., Journal of Natural Products, 65, (2002), 979