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Substance Name: Phellochin
RN: 115334-04-8
InChIKey: OCURJKDUYAFAQG-RLXWAGRASA-N

Molecular Formula

  • C31-H52-O4

Molecular Weight

  • 488.748
 
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Names and Synonyms

Results Name

  • Phellochin

Synonyms

  • 24,25-Deepoxy-24-hydroxy-25-methoxyniloticin
  • Phellochin

Systematic Name

  • Lanost-7-en-3-one, 23,24-dihydroxy-25-methoxy-, (13alpha,14beta,17alpha,20S,23R,24S)-

Registry Numbers

CAS Registry Number

  • 115334-04-8

System Generated Number

  • 0115334048

Structure Descriptors

InChI

1S/C31H52O4/c1-19(18-23(32)26(34)28(4,5)35-9)20-12-16-31(8)22-10-11-24-27(2,3)25(33)14-15-29(24,6)21(22)13-17-30(20,31)7/h10,19-21,23-24,26,32,34H,11-18H2,1-9H3/t19-,20+,21-,23+,24?,26-,29+,30-,31+/m0/s1

InChIKey

OCURJKDUYAFAQG-RLXWAGRASA-N

Smiles

C1(CC[C@@]2([C@H]3CC[C@@]4([C@H](CC[C@@]4(C3=CC[C@@H]2C1(C)C)C)[C@H](C[C@H]([C@@H](C(C)(C)OC)O)O)C)C)C)=O