(Q82963522)

English

9-(2-Deoxypentofuranosyl)-2-[(7,8,9-trihydroxy-7,8,9,10-tetrahydrobenzo[pqr]tetraphen-10-yl)imino]-3,9-dihydro-2H-purin-6-ol

group of stereoisomers with the chemical formula C₃₀H₂₇N₅O₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

569.1910482039999 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₀H₂₇N₅O₇

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based on heuristic

inferred from SMILES

canonical SMILES

OCC1OC(n2cnc3c(O)nc(=NC4c5c(cc6ccc7cccc8ccc5c6c78)C(O)C(O)C4O)[nH]c32)CC1O

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

OC[C@H]1O[C@@H](n2cnc3c(O)nc(=NC4c5c(cc6ccc7cccc8ccc5c6c78)C(O)C(O)C4O)[nH]c32)C[C@@H]1O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C30H27N5O7/c36-10-18-17(37)9-19(42-18)35-11-31-24-28(35)33-30(34-29(24)41)32-23-22-15-7-6-13-3-1-2-12-4-5-14(21(15)20(12)13)8-16(22)25(38)27(40)26(23)39/h1-8,11,17-19,23,25-27,36-40H,9-10H2,(H2,32,33,34,41)/t17-,18+,19+,23?,25?,26?,27?/m0/s1

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InChIKey

WOKFWJGVLJVTLH-STDLFCEZSA-N

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26 December 2021

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DSSTOX compound identifier

DTXCID701405511

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(Q82963522)

9-(2-Deoxypentofuranosyl)-2-[(7,8,9-trihydroxy-7,8,9,10-tetrahydrobenzo[pqr]tetraphen-10-yl)imino]-3,9-dihydro-2H-purin-6-ol

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