Summary

IMPPAT Phytochemical identifier: IMPHY015675

Phytochemical name: Tetracosamethyl-cyclododecasiloxane

Synonymous chemical names:
etracosamethyl cyclododeca siloxan

External chemical identifiers:
CID:167767, SureChEMBL:SCHEMBL6832751

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Chemical structure information

SMILES:
C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C

InChI:
InChI=1S/C24H72O12Si12/c1-37(2)25-38(3,4)27-40(7,8)29-42(11,12)31-44(15,16)33-46(19,20)35-48(23,24)36-47(21,22)34-45(17,18)32-43(13,14)30-41(9,10)28-39(5,6)26-37/h1-24H3

InChIKey:
SOGKSNZFDBFKCV-UHFFFAOYSA-N

DeepSMILES:
C[Si]C)O[Si]C)C)O[Si]C)C)O[Si]C)C)O[Si]C)C)O[Si]C)C)O[Si]O[Si]O[Si]O[Si]O[Si]O[Si]O%24)C)C)))C)C)))C)C)))C)C)))C)C)))C)C

Functional groups:
C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O1

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O1[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]1

Scaffold Graph/Node level:
O1[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]1

Scaffold Graph level:
C1CCCCCCCCCCCCCCCCCCCCCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organometallic compounds

ClassyFire Class: Organometalloid compounds

ClassyFire Subclass: Organosilicon compounds

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP-Likeness score: 0.008

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Chemical structure download