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3-(4-Methoxyspiro[1,2-dioxetane-3,2'-tricyclo[3.3.1.1~3,7~]decan]-4-yl)phenyl 2,3,4,5,6-pentahydroxycyclohexyl hydrogen phosphate

HCID 192580
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Basic information

CAS
152305-53-8
Standard SMILES
COC1(c2cccc(OP(=O)(O)OC3C(O)C(O)C(O)C(O)C3O)c2)OOC12C1CC3CC(C1)CC2C3
InChIKey
FGAATWUKMRDHGX-UHFFFAOYSA-N
Molecular formula
C24H33O12P
Average molar mass
544.49 g/mol
Monoisotopic mass
544.17096313

Names & identifiers

Preferred name
3-(4-Methoxyspiro[1,2-dioxetane-3,2'-tricyclo[3.3.1.1~3,7~]decan]-4-yl)phenyl 2,3,4,5,6-pentahydroxycyclohexyl hydrogen phosphate
IUPAC
3-(4-Methoxyspiro[[1,2]dioxetane-3,2'-tricyclo[3.3.1.1~3,7~]decan]-4-yl)phenyl 2,3,4,5,6-pentahydroxycyclohexyl hydrogen phosphate
English name
3-((4-methoxyspiro(1,2-dioxetane-3,2'-tricyclo(3.3.1.1(3,7))decan)-4-yl))phenyl myo-inositol-1-O-hydrogen phosphate
Molecular formula
C24H33O12P
Molecular weight
544.49

Names & synonyms

Lumi-PI1-[3-(4-Methoxyspiro[1,2-dioxetane-3,2'-tricyclo[3.3.1.13,7]decan]-4-yl)phenyl hydrogen phosphate] myo-inositolmyo-Inositol, 1-[3-(4-methoxyspiro[1,2-dioxetane-3,2'-tricyclo[3.3.1.13,7]decan]-4-yl)phenyl hydrogen phosphate]3-((4-methoxyspiro(1,2-dioxetane-3,2'-tricyclo(3.3.1.1(3,7))decan)-4-yl))phenyl myo-inositol-1-O-hydrogen phosphate

Database identifiers

CAS
152305-53-8
PubChem CID
192580
DTXSID
DTXSID70934464

Properties

Physicochemical properties

Boiling point
686.2 · 686.2±65.0 °C(Predicted)
Density
1.62 · 1.62±0.1 g/cm3(Predicted)
pka
1.28 · 1.28±0.50(Predicted)

Chemistry & industry

Suppliers3 total

深圳市金赛途生物科技有限公司0755-23251735 13302967066 · [email protected]
上海楷森生物科技有限公司17558870519 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]

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