input word = C00041859

Metabolite InformationStructural formula
Name Secaubryenol
(+)-Secaubryenol
Formula C30H48O3
Mw 456.3603454
CAS RN 925932-08-7
C_ID C00041859 ,
InChIKey JFCYFLMAPFEZKC-PRJMUDHTNA-N
InChICode InChI=1S/C30H48O3/c1-20(2)8-7-9-21(3)23-12-14-28(6)25-11-10-24(22(4)18-31)29(15-13-26(32)33)19-30(25,29)17-16-27(23,28)5/h8,21,23-25,31H,4,7,9-19H2,1-3,5-6H3,(H,32,33)/t21-,23-,24+,25+,27-,28+,29-,30+/m1/s1
SMILES C1[C@@H]2[C@]3([C@]([C@@H](C1)C(=C)CO)(CCC(=O)O)C3)CC[C@]1([C@]2(CC[C@@H]1[C@@H](CCC=C(C)C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeGardenia aubryi Ref.
PlantaeRubiaceaeGardenia sootepensis Ref.
PlantaeRubiaceaeGardenia tubifera Ref.
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