input word = C00041455

Metabolite InformationStructural formula
Name Crassocolide A
(+)-Crassocolide A
Formula C22H32O6
Mw 392.21988875
CAS RN 916609-07-9
C_ID C00041455 ,
InChIKey LOBTUTHTMBAWQV-ORKFSJKVNA-N
InChICode InChI=1S/C22H32O6/c1-13-8-6-10-14(2)19(27-16(4)23)20-17(15(3)21(25)28-20)12-18(24)22(5,26)11-7-9-13/h9-10,17-20,24,26H,3,6-8,11-12H2,1-2,4-5H3/b13-9-,14-10+/t17-,18+,19+,20-,22-/m1/s1
SMILES C=C1C(=O)O[C@@H]2[C@@H]1C[C@H](O)[C@](C)(O)CC/C=C(/C)CC/C=C(C)[C@@H]2OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeSarcophyton crassocaule Ref.
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OrganismSarcophyton crassocaule
ReferenceHuang,J.Nat.Prod.,69,(2006),1554