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Substance Name: Chondrillasterol
RN: 481-17-4
UNII: 20N2XP8UR6
InChIKey: JZVFJDZBLUFKCA-INYURWPISA-N

Note

  • Antiproliferative from Albizia glaberrima.

Molecular Formula

  • C29-H48-O

Molecular Weight

  • 412.6972
 
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Names and Synonyms

Name of Substance

  • Chondrillasterol

Synonyms

  • 24beta-Ethylcholesta-7,22-dien-3beta-ol
  • 5alpha-Stigmasta-7,22-dien-3beta-ol, (24R)-
  • Chondrillasterol
  • Chondrillasterol [MI]
  • Chondryllasterol
  • Stigmasta-7,22-dien-3-ol, (3beta,5alpha,22E,24R)-
  • trans-delta22-24beta-Ethyllathosterol
  • UNII-20N2XP8UR6

Registry Numbers

CAS Registry Number

  • 481-17-4

FDA UNII

  • 20N2XP8UR6

System Generated Number

  • 0000481174

Structure Descriptors

InChI

1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-9,11,19-23,25-27,30H,7,10,12-18H2,1-6H3/b9-8+/t20-,21+,22+,23+,25-,26+,27+,28+,29-/m1/s1

InChIKey

JZVFJDZBLUFKCA-INYURWPISA-N

Smiles

CC[C@@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 168.5 deg C   EXP
log P (octanol-water) 9.430 (none)   EST
Atmospheric OH Rate Constant 1.84E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.