input word = C00023466

Metabolite InformationStructural formula
Name 2beta-Hydroxy-1alpha-hydroxymethylcolensene-2alpha-carboxylic acid lactone
Formula C21H32O4
Mw 348.23005951
CAS RN 28644-78-2
C_ID C00023466 ,
InChIKey CHSJHRGRADQFEP-VUOHCWEINA-N
InChICode InChI=1S/C21H32O4/c1-7-18(4)10-8-14-19(5,25-18)11-9-13-17(2,3)21(23)15(20(13,14)6)12-24-16(21)22/h7,13-15,23H,1,8-12H2,2-6H3/t13-,14+,15+,18-,19+,20-,21+/m0/s1
SMILES [C@@]12([C@@H](CC[C@@]3([C@H]1CC[C@@](O3)(C=C)C)C)C([C@]1([C@@H]2COC1=O)O)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePodocarpaceaeDacrydium colensoi Ref.
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OrganismDacrydium colensoi
ReferenceGrant,Aust. J. Chem.,26,(1970),1631