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Substance Name: 3-O-(6'-O-Stearoylglucosyl)stigmasta-5,25(27)-diene
RN: 123564-58-9
InChIKey: OYZQYQSPKPQLFO-QZQJMBPMSA-N

Note

  • Antimutagen from Momordica charantia.

Molecular Formula

  • C53-H92-O7

Molecular Weight

  • 841.303
 
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Names and Synonyms

Name of Substance

  • 3-O-(6'-O-Stearoylglucosyl)stigmasta-5,25(27)-diene

Synonyms

  • 3-O-(6'-O-Stearoyl-beta-D-glucosyl)stigmasta-5,25(27)-dien
  • 3-Sgsgd

Systematic Name

  • beta-D-Glucopyranoside, (3beta,24S)-stigmasta-5,25-dien-3-yl, 6-octdecanoate

Registry Numbers

CAS Registry Number

  • 123564-58-9

System Generated Number

  • 0123564589

Structure Descriptors

InChI

1S/C53H92O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-47(54)58-36-46-48(55)49(56)50(57)51(60-46)59-41-31-33-52(6)40(35-41)27-28-42-44-30-29-43(53(44,7)34-32-45(42)52)38(5)25-26-39(9-2)37(3)4/h27,38-39,41-46,48-51,55-57H,3,8-26,28-36H2,1-2,4-7H3/t38-,39+,41?,42?,43-,44?,45?,46-,48-,49+,50-,51-,52+,53-/m1/s1

InChIKey

OYZQYQSPKPQLFO-QZQJMBPMSA-N

Smiles

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)COC(CCCCCCCCCCCCCCCCC)=O)[C@@H]1CC[C@@]2([C@@H]3CC[C@@]4([C@H](CC[C@@H]4[C@@H]3CC=C2C1)[C@@H](CC[C@H](CC)C(=C)C)C)C)C