input word = C00064218

Metabolite InformationStructural formula
Name Salvadiol
Formula C30H42O5
Mw 482.30322445
CAS RN 251316-65-1
C_ID C00064218
InChIKey MHIJTGZNQRDVQJ-AZGWLTBJSA-N
InChICode InChI=1S/C30H42O5/c1-8-18-14-19-21(25(6,7)33)29(17(2)3)22(31)26(15-18)13-10-20-24(4,5)11-9-12-27(20)16-28(19,26)30(34,35-27)23(29)32/h8,14,17,19-21,33-34H,1,9-13,15-16H2,2-7H3/t19-,20+,21-,26+,27+,28+,29-,30+/m1/s1
SMILES C=CC1=CC2C(C(C)(C)O)C3(C(C)C)C(=O)C4(CCC5C(C)(C)CCCC56CC24C(O)(O6)C3=O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia bucharica Ref.
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