(3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-Isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione | CAS No. 38647-11-9

(3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-Isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione

Basic Information

CAS Number

38647-11-9

Molecular Formula

C20H22O6

Molecular Weight

358.39 g/mol

AD

Basic Physical Properties

Physical State

Powder

Melting Point

No data available

Boiling Point

581.1±50.0 °C at 760 mmHg

Density

1.48

Flash Point

257.8±30.2 °C

Refractive Index

1.637

CC(C)C12C(O1)C3C4(O3)C5(CCC6=C(C5CC7C4(C2=O)O7)COC6=O)C

InChI

InChI=1S/C20H22O6/c1-8(2)18-13(25-18)14-20(26-14)17(3)5-4-9-10(7-23-15(9)21)11(17)6-12-19(20,24-12)16(18)22/h8,11-14H,4-7H2,1-3H3/t11-,12-,13-,14-,17-,18-,19+,20+/m0/s1

InChIKey

SWOVVKGLGOOUKI-ZHGGVEMFSA-N

LogP

1.3112999999999997

Topological Polar Surface Area

80.96000000000001 Ų

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

860

Safety Information

View Safety Information

Hazard Statement

Storage Conditions

2-8℃

Synonyms & References

English

  • Spectrum_001724
  • NCI60_001273
  • Triptolide,14-deoxy-14-oxo
  • KBio2_007340
  • NSC 165677
  • AKOS015896754
  • Triptolide, 14-deoxy-14-oxo-
  • Spectrum5_001806
  • SPBio_000614
  • Trisoxireno[4b,5:6,7:8a,9]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione,3b,4,4a,7a,7b,8b,9,10-octahydro-8b-methyl-6a-(1-methylethyl)-,(3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-
  • SCHEMBL4884926
  • CHEBI:132267
  • KBio1_001608
  • KBio2_004772
  • Triptonide
  • (1S,2S,4S,5S,7S,9S,11S,13S)-1-methyl-7-propan-2-yl-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-ene-8,17-dione
  • CHEMBL205190
  • KBio2_002204
  • CS-0318
  • DivK1c_006664
  • SpecPlus_000568
  • (-)-triptonide
  • CCG-38708
  • (5bS,6aS,7aS,8aS,9aS,9bS,10aS,10bS)-8a-Isopropyl-10b-methyl-1,5b,6,6a,8a,9a,9b,10b-octahydrotris(oxireno)[2',3':4b,5;2'',3'':6,7;2''',3''':8a,9]phenanthro[1,2-c]furan-3,8(2H,5H)-dione
  • (5bS,6aS,7aS,8aS,9aS,9bS,10aS,10bS)-8a-isopropyl-10b-methyl-2,5,5b,6,6a,9a,9b,10b-octahydrotris(oxireno)[2',3':4b,5;2'',3'':6,7;2''',3''':8a,9]phenanthro[1,2-c]furan-3,8(1H,8aH)-dione
  • KBioSS_002204
  • (3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione
  • EX-A7744
  • Triptonide, >=98% (HPLC)
  • NSC165677
  • NSC-165677

MDL Number

MFCD00210566

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