(Q106040914)

English

Prepacifenol epoxide

chemical compound

Poloxamer

In more languages

Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

441.954596412 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,1'R,2S,2'R,4S,4'S,5S,7'R)-5,7'-dibromo-4-chloro-4,4',6',6'-tetramethyl-3',8'-dioxaspiro[cyclohexane-1,5'-tricyclo[5.1.0.0²,⁴]octan]-2-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₁Br₂ClO₃

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1(Cl)CC(O)C2(CC1Br)C1(C)OC1C1OC1(Br)C2(C)C

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC1(C)[C@@]2(Br)O[C@H]2[C@@H]2O[C@]2(C)[C@@]12C[C@@H](Br)[C@](C)(Cl)C[C@H]2O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C15H21Br2ClO3/c1-11(2)14(5-7(16)12(3,18)6-8(14)19)13(4)9(20-13)10-15(11,17)21-10/h7-10,19H,5-6H2,1-4H3/t7-,8-,9+,10+,12-,13+,14-,15+/m1/s1

1 reference

ChEBI release 2021-03-01

AHEAISCIGHPMGI-WCRSPUDYSA-N

1 reference

ChEBI release 2021-03-01

2 references

ChEBI release 2021-03-01

matched by identifier from

AHEAISCIGHPMGI-WCRSPUDYSA-N

mapping relation type

2 references

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C15H21Br2ClO3/c1-11(2)14(5-7(16)12(3,18)6-8(14)19)13(4)9(20-13)10-15(11,17)21-10/h7-10,19H,5-6H2,1-4H3/t7-,8-,9+,10+,12-,13+,14-,15+/m1/s1

UniChem compound ID

1 reference

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