(Q105110379)

English

(2R,8R,13R,19R)-8-butyl-19-(4-hydroxybutyl)-2,13-dimethyltricyclo[18.2.2.29,12]hexacosa-1(22),9,11,20,23,25-hexaene-10,21,24,26-tetrol

chemical compound

In more languages

Statements

type of chemical entity

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8-Butyl-19-(4-hydroxybutyl)-2,13-dimethyltricyclo[18.2.2.29,12]hexacosa-1(22),9,11,20,23,25-hexaene-10,21,24,26-tetrol

1 reference

based on heuristic

inferred from SMILES

568.412774892 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Merocyclophane C

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based on heuristic

inferred from InChI

chemical formula

C₃₆H₅₆O₅

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canonical SMILES

OC=1C=C2C=C(O)C1C(CCCC)CCCCCC(C3=CC(O)=C(C(O)=C3)C(CCCCO)CCCCCC2C)C

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isomeric SMILES

CCCC[C@@H]1CCCCC[C@@H](C)c2cc(O)c(c(O)c2)[C@@H](CCCCO)CCCCC[C@@H](C)c2cc(O)c1c(O)c2

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1 reference

Merocyclophanes C and D from the Cultured Freshwater Cyanobacterium Nostoc sp. (UIC 10110).

Identifiers

InChI=1S/C36H56O5/c1-4-5-16-27-17-10-6-8-14-26(3)30-23-33(40)36(34(41)24-30)28(19-12-13-20-37)18-11-7-9-15-25(2)29-21-31(38)35(27)32(39)22-29/h21-28,37-41H,4-20H2,1-3H3/t25-,26-,27-,28-/m1/s1

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HSRXNKIXELDMBE-BIYDSLDMSA-N

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UniChem compound ID

1 reference

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