Marcellomycin

CAS Registry Number®

63710-10-1

CAS Name

Marcellomycin

Molecular Formula

C42H55NO17

Molecular Mass

845.88

Cite this Page

Marcellomycin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=63710-10-1 (retrieved 2024-11-22) (CAS RN: 63710-10-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H55NO17/c1-8-42(53)15-26(30-19(34(42)41(52)54-7)11-20-31(37(30)50)38(51)33-23(45)10-9-22(44)32(33)36(20)49)58-27-12-21(43(5)6)39(17(3)56-27)59-29-14-25(47)40(18(4)57-29)60-28-13-24(46)35(48)16(2)55-28/h9-11,16-18,21,24-29,34-35,39-40,44-48,50,53H,8,12-15H2,1-7H3/t16-,17-,18-,21-,24-,25-,26-,27-,28-,29-,34-,35+,39+,40+,42+/m0/s1

InChIKey

InChIKey=VJRAUFKOOPNFIQ-TVEKBUMESA-N

SMILES

O([C@@H]1C2=C([C@@H](C(OC)=O)[C@](CC)(O)C1)C=C3C(=C2O)C(=O)C=4C(C3=O)=C(O)C=CC4O)[C@H]5C[C@H](N(C)C)[C@H](O[C@H]6C[C@H](O)[C@H](O[C@H]7C[C@H](O)[C@H](O)[C@H](C)O7)[C@H](C)O6)[C@H](C)O5

Canonical SMILES

O=C1C=2C=C3C(=C(O)C2C(=O)C=4C(O)=CC=C(O)C14)C(OC5OC(C)C(OC6OC(C)C(OC7OC(C)C(O)C(O)C7)C(O)C6)C(N(C)C)C5)CC(O)(CC)C3C(=O)OC

Other Names for this Substance

  • 1-Naphthacenecarboxylic acid, 4-[[O-2,6-dideoxy-α-L-lyxo-hexopyranosyl-(1→4)-O-2,6-dideoxy-α-L-lyxo-hexopyranosyl-(1→4)-2,3,6-trideoxy-3-(dimethylamino)-α-L-lyxo-hexopyranosyl]oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,10-tetrahydroxy-6,11-dioxo-, methyl ester, (1R,2R,4S)-
  • 1-Naphthacenecarboxylic acid, 4-[[O-2,6-dideoxy-α-L-lyxo-hexopyranosyl-(1→4)-O-2,6-dideoxy-α-L-lyxo-hexopyranosyl-(1→4)-2,3,6-trideoxy-3-(dimethylamino)-α-L-lyxo-hexopyranosyl]oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,10-tetrahydroxy-6,11-dioxo-, methyl ester, [1R-(1α,2β,4β)]-
  • Marcellomycin
  • Antibiotic MA 144U2
  • NSC 265211

View All

Deleted or Replaced CAS Registry Numbers

64256-11-7

CAS INSIGHTSTM
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