Myrianthic acid

CAS Registry Number®

89786-84-5

CAS Name

Myrianthic acid

Molecular Formula

C30H48O6

Molecular Mass

504.70

Cite this Page

Myrianthic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=89786-84-5 (retrieved 2024-11-25) (CAS RN: 89786-84-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    255-257 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H48O6/c1-17-9-12-30(24(34)35)14-13-27(4)18(22(30)29(17,6)36)7-8-21-25(2)15-19(32)23(33)26(3,16-31)20(25)10-11-28(21,27)5/h7,17,19-23,31-33,36H,8-16H2,1-6H3,(H,34,35)/t17-,19-,20-,21-,22-,23-,25+,26+,27-,28-,29-,30+/m1/s1

InChIKey

InChIKey=YCOKATFNRPZIIU-MGBZEVKYSA-N

SMILES

C(O)(=O)[C@]12[C@](C=3[C@@](C)(CC1)[C@@]4(C)[C@](CC3)([C@]5(C)[C@@](CC4)([C@@](CO)(C)[C@H](O)[C@H](O)C5)[H])[H])([C@](C)(O)[C@H](C)CC2)[H]

Canonical SMILES

O=C(O)C12CCC(C)C(O)(C)C2C3=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC4(C)C3(C)CC1

Other Names for this Substance

  • Urs-12-en-28-oic acid, 2,3,19,23-tetrahydroxy-, (2α,3α,4α)-
  • (2α,3α,4α)-2,3,19,23-Tetrahydroxyurs-12-en-28-oic acid
  • Myrianthic acid
  • 2α,3α,19α,23-Tetrahydroxyurs-12-en-28-oic acid

Deleted or Replaced CAS Registry Numbers

65669-84-3

CAS INSIGHTSTM
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