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Substance Name: Tripdiolide
RN: 38647-10-8
UNII: 7VRC678RTA
InChIKey: PUJWFVBVNFXCHZ-SQEQANQOSA-N

Molecular Formula

  • C20-H24-O7

Molecular Weight

  • 376.4026
 
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Names and Synonyms

Name of Substance

  • Tripdiolide

Synonyms

  • NSC 163063
  • Tripdiolid
  • Tripdiolide
  • Triptodiolide
  • Triptolide, 2-hydroxy-, (2-beta)-
  • UNII-7VRC678RTA

Systematic Names

  • (2beta)-2-Hydroxytriptolide
  • Triptolide, 2-hydroxy-, (2beta)- (9CI)
  • Trisoxireno(4b,5:6,7:8a,9)phenanthro(1,2-c)furan-1(3H)-one, 3b,4,4a,6,6a,7a,7b,8b,9,10-decahydro-6,10-dihydroxy-8b-methyl-6a-(1- methylethyl)-, (3bS,4aS,5aS,6R,6aR,7aS,7bS,8aS,8bS,10S)-

Registry Numbers

CAS Registry Number

  • 38647-10-8

FDA UNII

  • 7VRC678RTA

System Generated Number

  • 0038647108

Structure Descriptors

InChI

1S/C20H24O7/c1-7(2)18-13(26-18)14-20(27-14)17(3)5-10(21)12-8(6-24-15(12)22)9(17)4-11-19(20,25-11)16(18)23/h7,9-11,13-14,16,21,23H,4-6H2,1-3H3/t9-,10-,11-,13-,14-,16+,17-,18-,19+,20+/m0/s1

InChIKey

PUJWFVBVNFXCHZ-SQEQANQOSA-N

Smiles

CC(C)[C@@]12[C@@H](O1)[C@H]3[C@@]4(O3)[C@]5(C[C@@H](C6=C([C@@H]5C[C@H]7[C@]4([C@@H]2O)O7)COC6=O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 889ug/kg (0.889mg/kg)   National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,