Qingyangshengenin

CAS Registry Number®

84745-94-8

CAS Name

Qingyangshengenin

Molecular Formula

C28H36O8

Molecular Mass

500.58

Cite this Page

Qingyangshengenin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=84745-94-8 (retrieved 2024-11-25) (CAS RN: 84745-94-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H36O8/c1-16(29)26(33)12-13-28(35)25(26,3)22(36-23(32)17-4-6-19(30)7-5-17)15-21-24(2)10-9-20(31)14-18(24)8-11-27(21,28)34/h4-8,20-22,30-31,33-35H,9-15H2,1-3H3/t20-,21+,22+,24-,25+,26+,27-,28+/m0/s1

InChIKey

InChIKey=IMRGSWAJVVVYOW-ZCARJHNXSA-N

SMILES

C[C@@]12[C@@](O)([C@@]3(O)[C@](C[C@H]1OC(=O)C4=CC=C(O)C=C4)([C@]5(C)C(=CC3)C[C@@H](O)CC5)[H])CC[C@]2(C(C)=O)O

Canonical SMILES

O=C(OC1CC2C(O)(CC=C3CC(O)CCC32C)C4(O)CCC(O)(C(=O)C)C14C)C5=CC=C(O)C=C5

Other Names for this Substance

  • Pregn-5-en-20-one, 3,8,14,17-tetrahydroxy-12-[(4-hydroxybenzoyl)oxy]-, (3β,12β,14β,17α)-
  • (3β,12β,14β,17α)-3,8,14,17-Tetrahydroxy-12-[(4-hydroxybenzoyl)oxy]pregn-5-en-20-one
  • Qingyanshengenin
  • Qingyangshengenin
  • NSC 379666

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