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Substance Name: Cinerubin R
RN: 147657-35-0
InChIKey: HIMMZWQWBNOPJH-UHFFFAOYSA-N

Note

  • Isolated from Streptomyces eurythermus.

Molecular Formula

  • C42-H51-N-O15

Molecular Weight

  • 809.8569
 
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Names and Synonyms

Name of Substance

  • Cinerubin R

Synonym

  • 4''-Aculosyl-4'-rhodinosyl-7-rhodosaminyl-epsilon-pyrromycinone

Systematic Name

  • 1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,10-tetrahydroxy-6,11-dioxo-4-((2,3,4-trideoxy-4-O-(5-((5,6-dihydro-6-methyl-5-oxo-2H-pyran-2-yl)oxy)tetrahydro-6-methyl-2H-pyran-2-yl)-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-, methyl ester, (2R-(2alpha(1R*,2R*,4S*),5beta(2R*,6S*),6beta))-

Registry Numbers

CAS Registry Number

  • 147657-35-0

System Generated Number

  • 0147657350

Structure Descriptors

InChI

1S/C42H51NO15/c1-8-42(51)17-28(32-21(36(42)41(50)52-7)15-22-33(38(32)48)39(49)35-26(46)10-9-25(45)34(35)37(22)47)57-31-16-23(43(5)6)40(20(4)55-31)58-30-14-12-27(19(3)54-30)56-29-13-11-24(44)18(2)53-29/h9-11,13,15,18-20,23,27-31,36,40,45-46,48,51H,8,12,14,16-17H2,1-7H3

InChIKey

HIMMZWQWBNOPJH-UHFFFAOYSA-N

Smiles

CCC1(CC(c2c(cc3c(c2O)C(=O)c4c(ccc(c4C3=O)O)O)C1C(=O)OC)OC5CC(C(C(O5)C)OC6CCC(C(O6)C)OC7C=CC(=O)C(O7)C)N(C)C)O