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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

Duocarmycin SA  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C25H23N3O7

inchi

  • InChI=1S/C25H23N3O7/c1-32-17-6-11-5-14(26-19(11)22(34-3)21(17)33-2)23(30)28-10-12-9-25(12)13-7-15(24(31)35-4)27-20(13)16(29)8-18(25)28/h5-8,12,26-27H,9-10H2,1-4H3/t12-,25-/m1/s1

inchikey

  • VQNATVDKACXKTF-XELLLNAOSA-N

mass

  • 477.473

monoisotopicmass

  • 477.15360

smiles

  • O=C1C=2NC(C(=O)OC)=CC2[C@]34[C@H](C3)CN(C4=C1)C(=O)C=5NC=6C(OC)=C(OC)C(=CC6C5)OC

subset

  • 2_STAR

synonym EXACT

  • methyl (1R,12S)-7-oxo-10-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-5,10-diazatetracyclo[7.4.0.01,12.02,6]trideca-2(6),3,8-triene-4-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207004

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