input word = C00023454

Metabolite InformationStructural formula
Name ent-13R-Hydroxy-14S,15-diacetoxy-1(10)-halimen-18-oic acid
Formula C24H38O7
Mw 438.26175357
CAS RN 129097-54-7
C_ID C00023454 ,
InChIKey CSEDYVUWKINDQS-LXZVAWPPNA-N
InChICode InChI=1S/C24H38O7/c1-15-9-10-19-18(8-7-11-23(19,5)21(27)28)22(15,4)12-13-24(6,29)20(31-17(3)26)14-30-16(2)25/h8,15,19-20,29H,7,9-14H2,1-6H3,(H,27,28)/t15-,19+,20-,22+,23+,24+/m1/s1
SMILES C1C[C@@]([C@@H]2C(=C1)[C@]([C@@H](CC2)C)(CC[C@]([C@@H](COC(=O)C)OC(=O)C)(C)O)C)(C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCistaceaeHalimium viscosum Ref.
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