Chemical Compound

J2.380.264C

J2.380.264C chemical structure
Primary Record

J2.380.264C

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177635699
SMILES
CC1=C(C=C2C=C1OC3=C(C=CC(=C3)[C@@H](C(=O)N[C@@H]4[C@@H](C5=CC=C(C=C5)OC6=CC7=CC(=C6O)OC8=CC=C(C=C8)[C@H]([C@H]9C(=O)NC(C1=C(C(=CC(=C1)O)O)C1=C(C=CC(=C1)[C@H](C(=O)N9)NC(=O)[C@@H]7NC(=O)C2NC4=O)O)C(=O)OC)O)O)NC1=C(C(=O)C1=O)NCC(=O)NCC(=O)NCC(=O)O)O)O
Canonical SMILES
COC(=O)C1NC(=O)[C@H]2NC(=O)[C@H](NC(=O)[C@@H]3NC(=O)C4NC(=O)[C@H](NC(=O)[C@@H](Nc5c(NCC(=O)NCC(=O)NCC(=O)O)c(=O)c5=O)c5ccc(O)c(c5)Oc5cc4cc(O)c5C)[C@H](O)c4ccc(cc4)Oc4cc3cc(c4O)Oc3ccc(cc3)[C@H]2O)c2ccc(O)c(c2)-c2c(O)cc(O)cc21

Names & Synonyms

  • J2.380.264C
  • 15-N-[2-[(7-Carboxy-2,5-dioxo-3,6-diazaheptane-1-yl)amino]-3,4-dioxo-1-cyclobutenyl]ristomycin A aglycone
  • 2-(2-{2-[(2-{[(1S,2R,18R,19R,22S,37R,40R)-2,18,26,31,44,47,49,64-octahydroxy-52-(methoxycarbonyl)-30-methyl-21,35,38,54,56,59-hexaoxo-7,13,28-trioxa-20,36,39,53,55,58-hexaazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8(64),9,11,14,16,23,25,27(61),29(60),30,32,41,43,45(57),46,48,50,62,65-henicosaen-22-yl]amino}-3,4-dioxocyclobut-1-en-1-yl)amino]acetamido}acetamido)acetic acid