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rolitetracycline

Go to external page http://purl.obolibrary.org/obo/CHEBI_63334

A derivative of tetracycline in which the amide function is substituted with a pyrrolidinomethyl group.

Term info

Label

rolitetracycline

Synonyms
  • (4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(pyrrolidin-1-ylmethyl)-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
database cross reference
Subsets

3_STAR

IUPAC NAME
(4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(pyrrolidin-1-ylmethyl)-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide [ IUPAC ]

INN
rolitetracycline [ KEGG_DRUG ]

BRAND NAME
Synterin [ KEGG_DRUG ]

INN
rolitetraciclina [ ChemIDplus ]

INN
rolitetracyclinum [ ChemIDplus ]

charge

0

formula

C27H33N3O8

has obo namespace

chebi_ontology

has related synonym

rolitetracycline, Reverin, Synterin, Pyrrolidino-methyl-tetracycline, N-(1-Pyrrolidinylmethyl)-tetracycline, rolitetracyclinum, rolitetraciclina, N-(Pyrrolidinomethyl)tetracycline

id

CHEBI:63334

inchi

InChI=1S/C27H33N3O8/c1-26(37)13-7-6-8-16(31)17(13)21(32)18-14(26)11-15-20(29(2)3)22(33)19(24(35)27(15,38)23(18)34)25(36)28-12-30-9-4-5-10-30/h6-8,14-15,20,31,33-34,37-38H,4-5,9-12H2,1-3H3,(H,28,36)/t14-,15-,20-,26+,27-/m0/s1

inchikey

HMEYVGGHISAPJR-IAHYZSEUSA-N

mass

527.56620

monoisotopicmass

527.22677

smiles

[H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCCC1)=C(O)[C@H]2N(C)C