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Substance Name: Maysine
RN: 52978-28-6
InChIKey: PDXPLYCPNXZSAL-ZBLADFMISA-N

Molecular Formula

  • C28-H35-Cl-N2-O7

Molecular Weight

  • 547.044
 
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Names and Synonyms

Name of Substance

  • Maysine

Synonyms

  • (2E)-3-De(2-(acetylmethylamino)-1-oxopropoxy)-2,3-didehydromaytansine
  • Maysine
  • NSC 219972

Systematic Name

  • Maytansine, 3-de(2-(acetylmethylamino)-1-oxopropoxy)-2,3-didehydro-, (2E)-

Registry Numbers

CAS Registry Number

  • 52978-28-6

System Generated Number

  • 0052978286

Structure Descriptors

InChI

1S/C28H35ClN2O7/c1-16-8-7-9-22(36-6)28(34)15-21(37-26(33)30-28)17(2)25-27(3,38-25)11-10-23(32)31(4)19-13-18(12-16)14-20(35-5)24(19)29/h7-11,13-14,17,21-22,25,34H,12,15H2,1-6H3,(H,30,33)/b9-7+,11-10-,16-8+

InChIKey

PDXPLYCPNXZSAL-ZBLADFMISA-N

Smiles

N1[C@@]2(C[C@@H](OC1=O)[C@@H](C)[C@@H]1O[C@@]1(C)C=CC(N(C)c1c(c(cc(CC(=CC=C[C@@H]2OC)C)c1)OC)Cl)=O)O