Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-
CAS Registry Number®
111150-27-7
CAS Name
Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-Molecular Formula
C30H44O4Molecular Mass
468.67Cite this Page
Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=111150-27-7 (retrieved ) (CAS RN: 111150-27-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
302-303 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C30H44O4/c1-25-15-19-18-7-8-21-27(3)11-10-22(32)28(4,17-31)20(27)9-12-30(21,6)29(18,5)14-13-26(19,2)23(16-25)34-24(25)33/h7-8,20-23,31-32H,9-17H2,1-6H3/t20-,21-,22+,23-,25-,26-,27+,28-,29-,30-/m1/s1
InChIKey
InChIKey=RIARKSMMKCXBML-SLMNGXHASA-N
SMILES
C[C@]12[C@@]3(C)C(=C4[C@@](C)(CC3)[C@]5(C[C@@](C)(C4)C(=O)O5)[H])C=C[C@@]1([C@]6(C)[C@@](CC2)([C@](CO)(C)[C@@H](O)CC6)[H])[H]
Canonical SMILES
O=C1OC2CC1(C)CC3=C4C=CC5C6(C)CCC(O)C(C)(CO)C6CCC5(C)C4(C)CCC32C
Other Names for this Substance
- Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-
- 4,2-(Epoxymethano)picene, oleana-11,13(18)-dien-29-oic acid deriv.
- Uralenolide