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Substance Name: Discarine D
RN: 88644-36-4
InChIKey: NXIUUPIVEHYUQL-BPBJPSLYSA-N

Note

  • From Discaria febrifuga.

Molecular Formula

  • C34-H40-N4-O4

Molecular Weight

  • 523.6297
 
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Names and Synonyms

Results Name

  • Discarine D

Synonym

  • Discarine D

Systematic Name

  • Pentanamide, 2-(dimethylamino)-N-(5,8-dioxo-3-phenyl-7-(phenylmethyl)-2-oxa-6,9-diazabicyclo(10.2.2)hexadeca-10,12,14,15-tetraen-4-yl)-4-methyl-

Registry Numbers

CAS Registry Number

  • 88644-36-4

System Generated Number

  • 0088644364

Structure Descriptors

InChI

1S/C32H33N3O4/c1-22(2)13-18-28(36)35-29-30(25-11-7-4-8-12-25)39-26-16-14-23(15-17-26)19-20-33-31(37)27(34-32(29)38)21-24-9-5-3-6-10-24/h3-20,22,27,29-30H,21H2,1-2H3,(H,33,37)(H,34,38)(H,35,36)/b18-13+,20-19-/t27-,29-,30-/m0/s1

InChIKey

NXIUUPIVEHYUQL-BPBJPSLYSA-N

Smiles

CC(C)\C=C\C(=O)N[C@H]1[C@@H](Oc2ccc(\C=C/NC(=O)[C@H](Cc3ccccc3)NC1=O)cc2)c4ccccc4