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Substance Name: Mycoplanecin A, 2-(4-methylproline)-
RN: 81018-84-0
InChIKey: JIGXVESWGUAPCN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C60-H100-N10-O13

Molecular Weight

  • 1169.507
 
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Names and Synonyms

Synonyms

  • 2-(4-Methylproline)mycoplanecin A
  • Mycoplanecin B

Systematic Name

  • Mycoplanecin A, 2-(4-methylproline)-

Registry Numbers

CAS Registry Number

  • 81018-84-0

System Generated Number

  • 0081018840

Structure Descriptors

InChI

1S/C60H100N10O13/c1-19-46(71)58(80)66(17)49(36(10)11)60(82)70-31-38(13)28-45(70)57(79)67(18)50-39(14)83-47(72)29-61-51(73)43(26-34(6)7)64(15)56(78)42-21-20-24-68(42)59(81)48(35(8)9)65(16)54(76)40(23-22-32(2)3)62-52(74)44-27-37(12)30-69(44)55(77)41(25-33(4)5)63-53(50)75/h32-45,48-50H,19-31H2,1-18H3,(H,61,73)(H,62,74)(H,63,75)

InChIKey

JIGXVESWGUAPCN-UHFFFAOYSA-N

Smiles

CCC(=O)C(=O)N(C)C(C(C)C)C(=O)N1CC(CC1C(=O)N(C)C2C(OC(=O)CNC(=O)C(N(C(=O)C3CCCN3C(=O)C(N(C(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(C)C)C)CCC(C)C)C)C(C)C)C)CC(C)C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 100mg/kg (100mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #81-140957,