input word = C00034415

Metabolite InformationStructural formula
Name Antillatoxin B
(-)-Antillatoxin B
Formula C33H47N3O5
Mw 565.35157163
CAS RN 357638-90-5
C_ID C00034415 ,
InChIKey WBQWYSKGOKXFTF-VBUNCOPTNA-N
InChICode InChI=1S/C33H47N3O5/c1-21(19-33(6,7)8)17-23(3)30-24(4)22(2)18-28(37)35-25(5)32(40)36(9)27(31(39)34-20-29(38)41-30)16-15-26-13-11-10-12-14-26/h10-14,17,19,24-25,27,30H,2,15-16,18,20H2,1,3-9H3,(H,34,39)(H,35,37)/b21-19+,23-17+/t24-,25-,27-,30+/m0/s1
SMILES C1(=O)[C@@H](N(C(=O)[C@@H](NC(=O)CC(=C)[C@@H]([C@H](OC(=O)CN1)/C(=C/C(=C/C(C)(C)C)/C)/C)C)C)C)CCc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
--Lyngbya majuscula Ref.
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