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14-Amino-6-hydroxy-6-(hydroxymethyl)-5-methyl-5,6,7,8-tetrahydro-13H-5,8-epoxy-4b,8a,14-triazadibenzo[b,h]cycloocta[1,2,3,4-jkl]cyclopenta[e]-as-indacene-13,15(14H)-dione

HCID 147342
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Basic information

CAS
118777-50-7
Standard SMILES
C[C@]12O[C@H](C[C@]1(O)CO)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)N(N)C4=O
InChIKey
JDUCOLPKZDHTNA-YIUNNBJSSA-N
Molecular formula
C26H20N4O5
Average molar mass
468.469 g/mol
Monoisotopic mass
468.14336974

Names & identifiers

Preferred name
14-Amino-6-hydroxy-6-(hydroxymethyl)-5-methyl-5,6,7,8-tetrahydro-13H-5,8-epoxy-4b,8a,14-triazadibenzo[b,h]cycloocta[1,2,3,4-jkl]cyclopenta[e]-as-indacene-13,15(14H)-dione
IUPAC
(5S,6S,8R)-14-Amino-6-hydroxy-6-(hydroxymethyl)-5-methyl-5,6,7,8-tetrahydro-13H-5,8-epoxy-4b,8a,14-triazadibenzo[b,h]cycloocta[1,2,3,4-jkl]cyclopenta[e]-as-indacene-13,15(14H)-dione

Database identifiers

CAS
118777-50-7
PubChem CID
147342
DTXSID
DTXSID80922771
Nikkaji
J480.064H

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