input word = C00049553

Metabolite InformationStructural formula
Name Geodiamolide R
Formula C27H38IN3O7
Mw 643.17544359
CAS RN 244157-99-1
C_ID C00049553 ,
InChIKey LQAKUUQGLPKZJX-NVNXTCNLNA-N
InChICode InChI=1S/C27H38IN3O7/c1-15-8-16(2)10-18(4)38-27(37)21(14-32)30-26(36)22(12-19-6-7-23(33)20(28)11-19)31(5)24(34)13-29-25(35)17(3)9-15/h6-8,11,16-18,21-22,32-33H,9-10,12-14H2,1-5H3,(H,29,35)(H,30,36)/b15-8+/t16-,17+,18-,21-,22+/m1/s1
SMILES C1[C@@H](/C=C(/C[C@@H](C(=O)NCC(=O)N([C@H](C(=O)N[C@@H](C(=O)O[C@@H]1C)CO)Cc1ccc(c(c1)I)O)C)C)\C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
AnimaliaAxinellidaeCymbastela sp. Ref.
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OrganismCymbastela sp.
ReferenceColeman,J.Nat.Prod.,62,(1999),1137