Chemical identity

Baumycin C2 (Mixture of Diastereomers)

CAS 64479-55-6 · C28H31NO11

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-07710
PubChem CID152687
NameBaumycin C2 (Mixture of Diastereomers)
CAS RN64479-55-6
Molecular formulaC28H31NO11
Molecular weight557.55 g/mol
IUPAC nameN-((2S,3S,4S,6R)-3-hydroxy-2-methyl-6-(((1S,3S)-3,5,12-trihydroxy-3-((R)-1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl)oxy)tetrahydro-2H-pyran-4-yl)formamide
InChIKeySTAZCZIPHWGTBD-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 152687
Two-dimensional chemical structure of Baumycin C2 (Mixture of Diastereomers), CAS 64479-55-6
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres7
Ring count5
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESCC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(C)O)O)NC=O)O
InChINot listed
Formula from structureC28H31NO11
Molecular weight from structure557.55 g/mol

03Stereochemistry

The published structure contains 0 defined and 7 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned
Unassigned centres7Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 128Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNO EXACT MATCH FOUNDCAS 64479-55-6 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 64479-55-6 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

05Names and relationships

Associated parent compound

Daunorubicin

View API and impurity family

Other names

  • 3,5,12-Trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-((hydroxymethylidene)amino)hexopyranoside
  • DTXSID20983048
  • RefChem:1065843
  • DTXCID201410298
  • Baumycin C2
  • 64479-55-6
  • N-[3-hydroxy-2-methyl-6-[[3,5,12-trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]formamide
  • N-Formyldihydrodaunomycin
  • 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-10-((2,3,6-trideoxy-3-(formylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-
  • PCA47955

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources