input word = C00061845

Metabolite InformationStructural formula
Name Dihydromangiferolic acid
Formula C30H50O3
Mw 458.37599546
CAS RN 4657-57-2
C_ID C00061845
InChIKey PJRTVYXYZKPRPE-SDBFQPSZSA-N
InChICode InChI=1S/C30H50O3/c1-19(8-7-9-20(2)25(32)33)21-12-14-28(6)23-11-10-22-26(3,4)24(31)13-15-29(22)18-30(23,29)17-16-27(21,28)5/h19-24,31H,7-18H2,1-6H3,(H,32,33)/t19-,20?,21-,22+,23+,24+,27-,28+,29-,30+/m1/s1
SMILES CC(CCCC(C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeMangifera indica Ref.
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OrganismMangifera indica
Referencehttps://doi.org/10.1016/S0040-4039(00)90194-1