halichondrin B
group of stereoisomers
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halichondrin B
Summary
halichondrin B is a group of stereoisomers[1].
Key Facts
- halichondrin B's instance of is recorded as group of stereoisomers[2].
- halichondrin B's canonical SMILES is recorded as O=C1OC2C(OC3CC4OC5(OC6C(OC7(OC8CC(OC8C(C)C7)C(O)CC(O)CO)CC6C)C5)CC4OC3C2C)CC9OC(CCC%10OC(CC%10=C)CCC%11%12OC%13C(OC%14C%13OC%15CCC(OC%15C%14O%11)C1)C%12)CC(C9=C)C[3].
- halichondrin B's InChI is recorded as InChI=1S/C60H86O19/c1-26-13-33-7-9-37-27(2)14-35(65-37)11-12-58-23-46-54(78-58)55-56(72-46)57(79-58)53-38(69-55)10-8-34(67-53)16-48(64)73-52-31(6)51-43(68-42(52)17-39(66-33)30(26)5)19-41-45(71-51)22-60(74-41)24-47-50(77-60)29(4)21-59(76-47)20-28(3)49-44(75-59)18-40(70-49)36(63)15-32(62)25-61/h26,28-29,31-47,49-57,61-63H,2,5,7-25H2,1,3-4,6H3[4].
- halichondrin B's InChIKey is recorded as FXNFULJVOQMBCW-UHFFFAOYSA-N[5].
- halichondrin B's chemical formula is recorded as C₆₀H₈₆O₁₉[6].
- halichondrin B's subclass of is recorded as macrolides[7].
- halichondrin B's PubChem CID is recorded as 5915307[8].
- halichondrin B's Human Metabolome Database ID is recorded as HMDB0259437[9].
- halichondrin B's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+1110.5763305320006'}[10].
- halichondrin B's SureChEMBL ID is recorded as 22116249[11].
- halichondrin B's UniChem compound ID is recorded as 67696047[12].