input word = C00048768

Metabolite InformationStructural formula
Name Marinoid C
(-)-Marinoid C
Formula C25H30O12
Mw 522.17372642
CAS RN 1048964-51-7
C_ID C00048768 ,
InChIKey LWORTIDRRYUBBP-FPDMNZKNNA-N
InChICode InChI=1S/C25H30O12/c1-25(33)9-8-14-15(22(31)32)11-34-23(18(14)25)37-24-21(20(30)19(29)16(10-26)35-24)36-17(28)7-4-12-2-5-13(27)6-3-12/h2-7,11,14,16,18-21,23-24,26-27,29-30,33H,8-10H2,1H3,(H,31,32)/b7-4+/t14-,16-,18-,19+,20+,21-,23+,24+,25-/m1/s1
SMILES O1C=C([C@@H]2[C@H]([C@@H]1O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1OC(=O)/C=C/c1ccc(cc1)O)O)O)CO)[C@](CC2)(C)O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAvicennia marina Ref.
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