Gamabufotalin
CAS Registry Number®
465-11-2
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CAS Name
GamabufotalinMolecular Formula
C24H34O5Molecular Mass
402.52Cite this Page
Gamabufotalin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=465-11-2 (retrieved ) (CAS RN: 465-11-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
254 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C24H34O5/c1-22-9-7-16(25)11-15(22)4-5-18-21(22)19(26)12-23(2)17(8-10-24(18,23)28)14-3-6-20(27)29-13-14/h3,6,13,15-19,21,25-26,28H,4-5,7-12H2,1-2H3/t15-,16+,17-,18-,19-,21-,22+,23-,24+/m1/s1
InChIKey
InChIKey=FMTLOAVOGWSPEF-KJRPADTMSA-N
SMILES
C[C@@]12[C@@](O)([C@]3([C@]([C@H](O)C1)([C@]4(C)[C@](CC3)(C[C@@H](O)CC4)[H])[H])[H])CC[C@@H]2C=5C=CC(=O)OC5
Canonical SMILES
O=C1OC=C(C=C1)C2CCC3(O)C4CCC5CC(O)CCC5(C)C4C(O)CC23C
Other Names for this Substance
- Bufa-20,22-dienolide, 3,11,14-trihydroxy-, (3β,5β,11α)-
- Gamabufotalin
- 5β-Bufa-20,22-dienolide, 3β,11α,14-trihydroxy-
- (3β,5β,11α)-3,11,14-Trihydroxybufa-20,22-dienolide
- Gamabufagin