input word = C00000499

Metabolite InformationStructural formula
Name Heliocide H1
Formula C25H30O5
Mw 410.20932407
CAS RN 65024-84-2
C_ID C00000499 ,
InChIKey FMJIKKXSIVRJGO-MQUDWQMYNA-N
InChICode InChI=1S/C25H30O5/c1-12(2)7-8-15-14(5)9-10-25(6)20(15)22(28)18-16(11-26)21(27)23(29)17(13(3)4)19(18)24(25)30/h7,9,11,13,15,20,27,29H,8,10H2,1-6H3/t15-,20+,25+/m1/s1
SMILES CC(C)=CC[C@@H]1C(C)=CC[C@]2(C)C(=O)c3c(c(C=O)c(O)c(O)c3C(C)C)C(=O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeGossypium hirsutum Ref.
PlantaeMalvaceaeGossypium sp. Ref.
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